2-[(4-ethanoylphenyl)carbamoyl]-5-nitro-benzoic acid

Systemtic Name: 2-[(4-ethanoylphenyl)carbamoyl]-5-nitro-benzoic acid Openeye Name: 2-[(4-acetylphenyl)carbamoyl]-5-nitro-benzoic acid CAS Name: 2-[(4-acetylanilino)-oxomethyl]-5-nitrobenzoic acid IUPAC Name: 2-[(4-acetylphenyl)carbamoyl]-5-nitrobenzoic acid Traditional Name: 2-[(4-acetylphenyl)carbamoyl]-5-nitro-benzoic acid Formula: C16H12N2O6 MolecularWeight: 328.27628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12N2O6/c1-9(19)10-2-4-11(5-3-10)17-15(20)13-7-6-12(18(23)24)8-14(13)16(21)22/h2-8H,1H3,(H,17,20)(H,21,22)