methyl 4-chloranyl-3-[3-[(2-nitrophenyl)amino]propanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[3-[(2-nitrophenyl)amino]propanoylamino]benzoate Openeye Name: methyl 4-chloro-3-[3-(2-nitroanilino)propanoylamino]benzoate CAS Name: 4-chloro-3-[[3-(2-nitroanilino)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[3-(2-nitroanilino)propanoylamino]benzoate Traditional Name: 4-chloro-3-[3-(2-nitroanilino)propanoylamino]benzoic acid methyl ester Formula: C17H16ClN3O5 MolecularWeight: 377.77904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O5/c1-26-17(23)11-6-7-12(18)14(10-11)20-16(22)8-9-19-13-4-2-3-5-15(13)21(24)25/h2-7,10,19H,8-9H2,1H3,(H,20,22)