1-[3-(3,4-dichlorophenyl)-1-(phenylcarbonyl)piperidin-3-yl]propyl methanesulfonate

Systemtic Name: 1-[3-(3,4-dichlorophenyl)-1-(phenylcarbonyl)piperidin-3-yl]propyl methanesulfonate Openeye Name: 1-[1-benzoyl-3-(3,4-dichlorophenyl)-3-piperidyl]propyl methanesulfonate CAS Name: methanesulfonic acid 1-[1-benzoyl-3-(3,4-dichlorophenyl)-3-piperidinyl]propyl ester IUPAC Name: 1-[1-benzoyl-3-(3,4-dichlorophenyl)piperidin-3-yl]propyl methanesulfonate Traditional Name: methanesulfonic acid 1-[1-benzoyl-3-(3,4-dichlorophenyl)-3-piperidyl]propyl ester Formula: C22H25Cl2NO4S MolecularWeight: 470.4092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1(CCCN(C1)C(=O)C2=CC=CC=C2)C3=CC(=C(C=C3)Cl)Cl)OS(=O)(=O)C

Isomeric SMILES

CCC(C1(CCCN(C1)C(=O)C2=CC=CC=C2)C3=CC(=C(C=C3)Cl)Cl)OS(=O)(=O)C

InChI

InChI=1S/C22H25Cl2NO4S/c1-3-20(29-30(2,27)28)22(17-10-11-18(23)19(24)14-17)12-7-13-25(15-22)21(26)16-8-5-4-6-9-16/h4-6,8-11,14,20H,3,7,12-13,15H2,1-2H3