[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-[(4-chlorophenyl)sulfanylmethyl]benzoate

Systemtic Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Openeye Name: [2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl] 4-[(4-chlorophenyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid [2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl] 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid [2-(2,6-dimethylpiperidino)-2-keto-ethyl] ester Formula: C23H26ClNO3S MolecularWeight: 431.97544

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)COC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1CCCC(N1C(=O)COC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C23H26ClNO3S/c1-16-4-3-5-17(2)25(16)22(26)14-28-23(27)19-8-6-18(7-9-19)15-29-21-12-10-20(24)11-13-21/h6-13,16-17H,3-5,14-15H2,1-2H3