Basic information
- CAS
116-80-3- Standard SMILES
COc1ccc(NC(=O)c2ccccc2)c2c1C(=O)c1c(Cl)cccc1C2=O- InChIKey
ZUENIEUULTXURC-UHFFFAOYSA-N- Molecular formula
- C22H14ClNO4
- Average molar mass
- 391.8 g/mol
- Monoisotopic mass
- 391.0611356
Names & identifiers
- Preferred name
- Benzamide, N-(5-chloro-4-methoxyanthraquinonyl)-
- IUPAC
- N-(5-chloro-4-methoxy-9,10-dioxoanthracen-1-yl)benzamide
- English name
- N-(5-chloro-4-methoxy-9,10-dioxo-9,10-dihydroanthracen-1-yl)benzamide
- Molecular formula
- C22H14ClNO4
- Molecular weight
- 391.8
Names & synonyms
116-80-3BENZAMIDE, N-(5-CHLORO-4-METHOXYANTHRAQUINONYL)-n-(5-chloro-4-methoxy-9,10-dioxo-9,10-dihydroanthracen-1-yl)benzamideN-(5-chloro-4-methoxy-9,10-dioxoanthracen-1-yl)benzamideBRN 2783838N-(5-Chloro-4-methoxyanthraquinonyl)benzamide1-Benzoylamino-4-methoxy-5-chloranthrachinon [Czech]1-Benzoylamino-5-chlor-4-methoxyanthrachinon [Czech]1-Benzoylamino-4-methoxy-5-chloranthrachinon1-Benzoylamino-5-chlor-4-methoxyanthrachinon2-14-00-00172 (Beilstein Handbook Reference)DTXSID80151261
Show more names
N-(5-chloro-9,10-diketo-4-methoxy-1-anthryl)benzamideN-(5-chloro-4-methoxy-9,10-dioxo-anthracen-1-yl)benzamideN-(5-Chloro-9,10-dihydro-4-methoxy-9,10-dioxoanthracen-1-yl)benzamideBenzamide, N-(5-chloro-9,10-dihydro-4-methoxy-9,10-dioxo-1-anthracenyl)-
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 72.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 632
Physicochemical properties
- Density
- 1.2161 · 1.2161 (rough estimate)
- refractive index
- 1.691 · 1.6910 (estimate)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers1 total
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Related reactions
0 records
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Compound notes
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