methyl 3-[(4-acetamidophenyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(4-acetamidophenyl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(4-acetamidophenyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[(4-acetamidoanilino)-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(4-acetamidophenyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(4-acetamidophenyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C17H15N3O6 MolecularWeight: 357.3175

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H15N3O6/c1-10(21)18-13-3-5-14(6-4-13)19-16(22)11-7-12(17(23)26-2)9-15(8-11)20(24)25/h3-9H,1-2H3,(H,18,21)(H,19,22)