methyl 4-[(3-aminophenyl)amino]-3-nitro-benzoate

Systemtic Name: methyl 4-[(3-aminophenyl)amino]-3-nitro-benzoate Openeye Name: methyl 4-(3-aminoanilino)-3-nitro-benzoate CAS Name: 4-(3-aminoanilino)-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-(3-aminoanilino)-3-nitrobenzoate Traditional Name: 4-(3-aminoanilino)-3-nitro-benzoic acid methyl ester Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O4/c1-21-14(18)9-5-6-12(13(7-9)17(19)20)16-11-4-2-3-10(15)8-11/h2-8,16H,15H2,1H3