ethyl 3-nitro-4-(phenylcarbonyl)benzoate

Systemtic Name: ethyl 3-nitro-4-(phenylcarbonyl)benzoate Openeye Name: ethyl 4-benzoyl-3-nitro-benzoate CAS Name: 4-benzoyl-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-benzoyl-3-nitrobenzoate Traditional Name: 4-benzoyl-3-nitro-benzoic acid ethyl ester Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO5/c1-2-22-16(19)12-8-9-13(14(10-12)17(20)21)15(18)11-6-4-3-5-7-11/h3-10H,2H2,1H3