methyl 4-[4-[(4-nitrophenyl)amino]butanoylamino]benzoate

Systemtic Name: methyl 4-[4-[(4-nitrophenyl)amino]butanoylamino]benzoate Openeye Name: methyl 4-[4-(4-nitroanilino)butanoylamino]benzoate CAS Name: 4-[[4-(4-nitroanilino)-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(4-nitroanilino)butanoylamino]benzoate Traditional Name: 4-[4-(4-nitroanilino)butanoylamino]benzoic acid methyl ester Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5/c1-26-18(23)13-4-6-15(7-5-13)20-17(22)3-2-12-19-14-8-10-16(11-9-14)21(24)25/h4-11,19H,2-3,12H2,1H3,(H,20,22)