3-Nitrobenzoic acid 2-(1,2-dihydro-5-methyl-2-oxo-1-propyl-3H-indol-3-ylidene)hydrazide
Basic information
- CAS
609779-52-4- Standard SMILES
CCCn1c(O)c(N=NC(=O)c2cccc([N+](=O)[O-])c2)c2cc(C)ccc21- InChIKey
DQYDCHIQFRYRSW-UHFFFAOYSA-N- Molecular formula
- C19H18N4O4
- Average molar mass
- 366.4 g/mol
- Monoisotopic mass
- 366.13280507
Names & identifiers
- Preferred name
- 3-Nitrobenzoic acid 2-(1,2-dihydro-5-methyl-2-oxo-1-propyl-3H-indol-3-ylidene)hydrazide
- IUPAC
- N-(2-hydroxy-5-methyl-1-propylindol-3-yl)imino-3-nitrobenzamide
Names & synonyms
DTXSID701125509AKOS0027038233-Nitrobenzoic acid 2-(1,2-dihydro-5-methyl-2-oxo-1-propyl-3H-indol-3-ylidene)hydrazide609779-52-4N'-(5-Methyl-2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)-3-nitrobenzohydrazide
Database identifiers
- CAS
609779-52-4- PubChem CID
- 4501412
- DTXSID
DTXSID701125509
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 579
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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