methyl 2-[3-[(2-nitrophenyl)amino]propanoylamino]benzoate

Systemtic Name: methyl 2-[3-[(2-nitrophenyl)amino]propanoylamino]benzoate Openeye Name: methyl 2-[3-(2-nitroanilino)propanoylamino]benzoate CAS Name: 2-[[3-(2-nitroanilino)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[3-(2-nitroanilino)propanoylamino]benzoate Traditional Name: 2-[3-(2-nitroanilino)propanoylamino]benzoic acid methyl ester Formula: C17H17N3O5 MolecularWeight: 343.33398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5/c1-25-17(22)12-6-2-3-7-13(12)19-16(21)10-11-18-14-8-4-5-9-15(14)20(23)24/h2-9,18H,10-11H2,1H3,(H,19,21)