methyl 5-[[(4-aminocarbonyl-2-nitro-phenyl)amino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[(4-aminocarbonyl-2-nitro-phenyl)amino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[(4-carbamoyl-2-nitro-anilino)methyl]-2-methoxy-benzoate CAS Name: 5-[(4-carbamoyl-2-nitroanilino)methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[(4-carbamoyl-2-nitroanilino)methyl]-2-methoxybenzoate Traditional Name: 5-[(4-carbamoyl-2-nitro-anilino)methyl]-2-methoxy-benzoic acid methyl ester Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C17H17N3O6/c1-25-15-6-3-10(7-12(15)17(22)26-2)9-19-13-5-4-11(16(18)21)8-14(13)20(23)24/h3-8,19H,9H2,1-2H3,(H2,18,21)