2-[3-(3,4-dichlorophenyl)-6-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]ethyl methanesulfonate

Systemtic Name: 2-[3-(3,4-dichlorophenyl)-6-oxidanylidene-1-(phenylmethyl)piperidin-3-yl]ethyl methanesulfonate Openeye Name: 2-[1-benzyl-3-(3,4-dichlorophenyl)-6-oxo-3-piperidyl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[3-(3,4-dichlorophenyl)-6-oxo-1-(phenylmethyl)-3-piperidinyl]ethyl ester IUPAC Name: 2-[1-benzyl-3-(3,4-dichlorophenyl)-6-oxopiperidin-3-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[1-benzyl-3-(3,4-dichlorophenyl)-6-keto-3-piperidyl]ethyl ester Formula: C21H23Cl2NO4S MolecularWeight: 456.38262

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC1(CCC(=O)N(C1)CC2=CC=CC=C2)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CS(=O)(=O)OCCC1(CCC(=O)N(C1)CC2=CC=CC=C2)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H23Cl2NO4S/c1-29(26,27)28-12-11-21(17-7-8-18(22)19(23)13-17)10-9-20(25)24(15-21)14-16-5-3-2-4-6-16/h2-8,13H,9-12,14-15H2,1H3