1-[4-[(4-chlorophenyl)methylsulfonylmethyl]-4-oxidanyl-piperidin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[(4-chlorophenyl)methylsulfonylmethyl]-4-oxidanyl-piperidin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[(4-chlorophenyl)methylsulfonylmethyl]-4-hydroxy-1-piperidyl]-3-methyl-butan-1-one CAS Name: 1-[4-[(4-chlorophenyl)methylsulfonylmethyl]-4-hydroxy-1-piperidinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[(4-chlorophenyl)methylsulfonylmethyl]-4-hydroxypiperidin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[(4-chlorobenzyl)sulfonylmethyl]-4-hydroxy-piperidino]-3-methyl-butan-1-one Formula: C18H26ClNO4S MolecularWeight: 387.92134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC(CC1)(CS(=O)(=O)CC2=CC=C(C=C2)Cl)O

Isomeric SMILES

CC(C)CC(=O)N1CCC(CC1)(CS(=O)(=O)CC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C18H26ClNO4S/c1-14(2)11-17(21)20-9-7-18(22,8-10-20)13-25(23,24)12-15-3-5-16(19)6-4-15/h3-6,14,22H,7-13H2,1-2H3