[(4-chlorophenyl)carbonylamino] 3-(3-methoxy-2-nitro-phenyl)propanoate

Systemtic Name: [(4-chlorophenyl)carbonylamino] 3-(3-methoxy-2-nitro-phenyl)propanoate Openeye Name: [(4-chlorobenzoyl)amino] 3-(3-methoxy-2-nitro-phenyl)propanoate CAS Name: 3-(3-methoxy-2-nitrophenyl)propanoic acid [[(4-chlorophenyl)-oxomethyl]amino] ester IUPAC Name: [(4-chlorobenzoyl)amino] 3-(3-methoxy-2-nitrophenyl)propanoate Traditional Name: 3-(3-methoxy-2-nitro-phenyl)propionic acid [(4-chlorobenzoyl)amino] ester Formula: C17H15ClN2O6 MolecularWeight: 378.7638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1[N+](=O)[O-])CCC(=O)ONC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=CC=CC(=C1[N+](=O)[O-])CCC(=O)ONC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H15ClN2O6/c1-25-14-4-2-3-11(16(14)20(23)24)7-10-15(21)26-19-17(22)12-5-8-13(18)9-6-12/h2-6,8-9H,7,10H2,1H3,(H,19,22)