3-(4-bromophenyl)sulfonyl-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-(4-bromophenyl)sulfonyl-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one Openeye Name: 1-(4-benzyl-1-piperidyl)-3-(4-bromophenyl)sulfonyl-propan-1-one CAS Name: 3-(4-bromophenyl)sulfonyl-1-[4-(phenylmethyl)-1-piperidinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-3-(4-bromophenyl)sulfonylpropan-1-one Traditional Name: 1-(4-benzylpiperidino)-3-brosyl-propan-1-one Formula: C21H24BrNO3S MolecularWeight: 450.38916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H24BrNO3S/c22-19-6-8-20(9-7-19)27(25,26)15-12-21(24)23-13-10-18(11-14-23)16-17-4-2-1-3-5-17/h1-9,18H,10-16H2