[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)carbonylamino]propanoate

Systemtic Name: [2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)carbonylamino]propanoate Openeye Name: [2-(2,3-dimethylanilino)-2-oxo-ethyl] 3-[(4-chlorobenzoyl)amino]propanoate CAS Name: 3-[[(4-chlorophenyl)-oxomethyl]amino]propanoic acid [2-(2,3-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dimethylanilino)-2-oxoethyl] 3-[(4-chlorobenzoyl)amino]propanoate Traditional Name: 3-[(4-chlorobenzoyl)amino]propionic acid [2-(2,3-dimethylanilino)-2-keto-ethyl] ester Formula: C20H21ClN2O4 MolecularWeight: 388.84474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)COC(=O)CCNC(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)COC(=O)CCNC(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C20H21ClN2O4/c1-13-4-3-5-17(14(13)2)23-18(24)12-27-19(25)10-11-22-20(26)15-6-8-16(21)9-7-15/h3-9H,10-12H2,1-2H3,(H,22,26)(H,23,24)