[2-[2-cyanoethyl(phenyl)amino]-2-oxidanylidene-ethyl] 1-(3-chlorophenyl)cyclobutane-1-carboxylate

Systemtic Name: [2-[2-cyanoethyl(phenyl)amino]-2-oxidanylidene-ethyl] 1-(3-chlorophenyl)cyclobutane-1-carboxylate Openeye Name: [2-[N-(2-cyanoethyl)anilino]-2-oxo-ethyl] 1-(3-chlorophenyl)cyclobutanecarboxylate CAS Name: 1-(3-chlorophenyl)-1-cyclobutanecarboxylic acid [2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(2-cyanoethyl)anilino]-2-oxoethyl] 1-(3-chlorophenyl)cyclobutane-1-carboxylate Traditional Name: 1-(3-chlorophenyl)cyclobutanecarboxylic acid [2-[N-(2-cyanoethyl)anilino]-2-keto-ethyl] ester Formula: C22H21ClN2O3 MolecularWeight: 396.86674

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)(C2=CC(=CC=C2)Cl)C(=O)OCC(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

C1CC(C1)(C2=CC(=CC=C2)Cl)C(=O)OCC(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C22H21ClN2O3/c23-18-8-4-7-17(15-18)22(11-5-12-22)21(27)28-16-20(26)25(14-6-13-24)19-9-2-1-3-10-19/h1-4,7-10,15H,5-6,11-12,14,16H2