Basic information
- CAS
5669-80-7- Standard SMILES
O=C1CCCC2=C1C(c1cccc([N+](=O)[O-])c1)C1C(=O)c3ccccc3C1=N2- InChIKey
NUQOCWFNLFYZNC-UHFFFAOYSA-N- Molecular formula
- C22H16N2O4
- Average molar mass
- 372.4 g/mol
- Monoisotopic mass
- 372.111007
Names & identifiers
- Preferred name
- 10-(3-nitrophenyl)-7,8,10,10a-tetrahydro-6H-indeno[1,2-b]quinoline-9,11-dione
- IUPAC
- 10-(3-nitrophenyl)-7,8,10,10a-tetrahydro-6H-indeno[1,2-b]quinoline-9,11-dione
- English name
- 3-Methyl-4-[2-(2-nitrophenyl)hydrazono]isoxazole-5(4H)-one
- Molecular formula
- C10H8N4O4
- Molecular weight
- 248.19
Names & synonyms
10-(3-nitrophenyl)-7,8,10,10a-tetrahydro-6H-indeno[1,2-b]quinoline-9,11-dione5669-80-710-{3-nitrophenyl}-7,8,10,10a-tetrahydro-6H-indeno[1,2-b]quinoline-9,11-dioneCBMicro_027651DTXSID40386350STK096490AKOS000618025AKOS002558795AKOS016301158BIM-0027535.P001EU-0044887ST50103217
Show more names
4,5-Isoxazoledione, 3-methyl-, 4-[2-(2-nitrophenyl)hydrazone]
AG-690/11835065AG-690/12767614SR-01000493274SR-01000493274-13-Methyl-4-[2-(2-nitrophenyl)hydrazono]isoxazole-5(4H)-one11-(3-nitrophenyl)-2,3,4,11,10a-pentahydrobenzo[1',2'-1,2]cyclopenta[3,4-b]qui noline-1,10-dione
Database identifiers
- CAS
5669-80-7- PubChem CID
- 2860187
- DTXSID
DTXSID40386350
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 793
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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