2-Propenamide, N-(4-chlorophenyl)-2-cyano-3-[2-hydroxy-5-[2-(4-nitrophenyl)diazenyl]phenyl]-
Basic information
- CAS
496020-93-0- Standard SMILES
N#CC(=Cc1cc(N=Nc2ccc([N+](=O)[O-])cc2)ccc1O)C(=O)Nc1ccc(Cl)cc1- InChIKey
HGBFMESRQIVYGF-UHFFFAOYSA-N- Molecular formula
- C22H14ClN5O4
- Average molar mass
- 447.8 g/mol
- Monoisotopic mass
- 447.0734316
Names & identifiers
- Preferred name
- 2-Propenamide, N-(4-chlorophenyl)-2-cyano-3-[2-hydroxy-5-[2-(4-nitrophenyl)diazenyl]phenyl]-
- IUPAC
- N-(4-chlorophenyl)-2-cyano-3-[2-hydroxy-5-[(4-nitrophenyl)diazenyl]phenyl]prop-2-enamide
Names & synonyms
DTXSID4010385752-Propenamide, N-(4-chlorophenyl)-2-cyano-3-[2-hydroxy-5-[2-(4-nitrophenyl)diazenyl]phenyl]-496020-93-0
Database identifiers
- CAS
496020-93-0- PubChem CID
- 4478699
- DTXSID
DTXSID401038575
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 773
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Related reactions
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Compound notes
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