[1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[(4-chlorophenyl)carbonylamino]propanoate

Systemtic Name: [1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-[(4-chlorophenyl)carbonylamino]propanoate Openeye Name: [2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] 3-[(4-chlorobenzoyl)amino]propanoate CAS Name: 3-[[(4-chlorophenyl)-oxomethyl]amino]propanoic acid [1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-cyanoanilino)-1-oxopropan-2-yl] 3-[(4-chlorobenzoyl)amino]propanoate Traditional Name: 3-[(4-chlorobenzoyl)amino]propionic acid [2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C20H18ClN3O4 MolecularWeight: 399.82762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)CCNC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)CCNC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H18ClN3O4/c1-13(19(26)24-17-5-3-2-4-15(17)12-22)28-18(25)10-11-23-20(27)14-6-8-16(21)9-7-14/h2-9,13H,10-11H2,1H3,(H,23,27)(H,24,26)