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

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

CS(=O)(=O)OCCCC1(CCCN(C1)C(=O)C2=CC=CC=C2)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CS(=O)(=O)OCCCC1(CCCN(C1)C(=O)C2=CC=CC=C2)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H25Cl2NO4S/c1-30(27,28)29-14-6-12-22(18-9-10-19(23)20(24)15-18)11-5-13-25(16-22)21(26)17-7-3-2-4-8-17/h2-4,7-10,15H,5-6,11-14,16H2,1H3