Basic information
- CAS
105772-57-4- Standard SMILES
O=C(Nc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1- InChIKey
UEXONOVXGVTNOX-UHFFFAOYSA-N- Molecular formula
- C17H12N2O3
- Average molar mass
- 292.29 g/mol
- Monoisotopic mass
- 292.08479225
Names & identifiers
- Preferred name
- N-(naphthalen-2-yl)-4-nitrobenzamide
- IUPAC
- N-naphthalen-2-yl-4-nitrobenzamide
Names & synonyms
N-(naphthalen-2-yl)-4-nitrobenzamide105772-57-4Benzamide, N-2-naphthalenyl-4-nitro-SCHEMBL2229702CHEMBL5276088DTXSID80351082STK094378AKOS001721298N-(2-naphthyl)(4-nitrophenyl)carboxamideST4016458SR-01000117012SR-01000117012-1
Database identifiers
- CAS
105772-57-4- PubChem CID
- 690183
- DTXSID
DTXSID80351082- ChEMBL
CHEMBL5276088- Nikkaji
- J1.885.131H
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 413
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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