[2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl] 1-(4-chlorophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: [2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl] 1-(4-chlorophenyl)carbonylpiperidine-4-carboxylate Openeye Name: [2-(2,4-dichlorophenyl)-2-oxo-ethyl] 1-(4-chlorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-4-piperidinecarboxylic acid [2-(2,4-dichlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dichlorophenyl)-2-oxoethyl] 1-(4-chlorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-chlorobenzoyl)isonipecotic acid [2-(2,4-dichlorophenyl)-2-keto-ethyl] ester Formula: C21H18Cl3NO4 MolecularWeight: 454.73092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC(=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)OCC(=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H18Cl3NO4/c22-15-3-1-13(2-4-15)20(27)25-9-7-14(8-10-25)21(28)29-12-19(26)17-6-5-16(23)11-18(17)24/h1-6,11,14H,7-10,12H2