methyl 3-[(4-chloranyl-2-nitro-phenyl)carbonylamino]-3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: methyl 3-[(4-chloranyl-2-nitro-phenyl)carbonylamino]-3-(3,4-dimethoxyphenyl)propanoate Openeye Name: methyl 3-[(4-chloro-2-nitro-benzoyl)amino]-3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-[[(4-chloro-2-nitrophenyl)-oxomethyl]amino]-3-(3,4-dimethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-[(4-chloro-2-nitrobenzoyl)amino]-3-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-[(4-chloro-2-nitro-benzoyl)amino]-3-(3,4-dimethoxyphenyl)propionic acid methyl ester Formula: C19H19ClN2O7 MolecularWeight: 422.81636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C19H19ClN2O7/c1-27-16-7-4-11(8-17(16)28-2)14(10-18(23)29-3)21-19(24)13-6-5-12(20)9-15(13)22(25)26/h4-9,14H,10H2,1-3H3,(H,21,24)