1-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]-3-(4-methylphenyl)sulfonyl-propan-1-one

Systemtic Name: 1-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]-3-(4-methylphenyl)sulfonyl-propan-1-one Openeye Name: 1-[4-[2-(p-tolyl)ethyl]-1-piperidyl]-3-(p-tolylsulfonyl)propan-1-one CAS Name: 1-[4-[2-(4-methylphenyl)ethyl]-1-piperidinyl]-3-(4-methylphenyl)sulfonyl-1-propanone IUPAC Name: 1-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]-3-(4-methylphenyl)sulfonylpropan-1-one Traditional Name: 1-[4-[2-(p-tolyl)ethyl]piperidino]-3-tosyl-propan-1-one Formula: C24H31NO3S MolecularWeight: 413.57284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C24H31NO3S/c1-19-3-7-21(8-4-19)9-10-22-13-16-25(17-14-22)24(26)15-18-29(27,28)23-11-5-20(2)6-12-23/h3-8,11-12,22H,9-10,13-18H2,1-2H3