5-[4-(phenylmethyl)piperidin-1-yl]sulfonylisoquinoline

Systemtic Name: 5-[4-(phenylmethyl)piperidin-1-yl]sulfonylisoquinoline Openeye Name: 5-[(4-benzyl-1-piperidyl)sulfonyl]isoquinoline CAS Name: 5-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]isoquinoline IUPAC Name: 5-(4-benzylpiperidin-1-yl)sulfonylisoquinoline Traditional Name: 5-(4-benzylpiperidino)sulfonylisoquinoline Formula: C21H22N2O2S MolecularWeight: 366.47658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C21H22N2O2S/c24-26(25,21-8-4-7-19-16-22-12-9-20(19)21)23-13-10-18(11-14-23)15-17-5-2-1-3-6-17/h1-9,12,16,18H,10-11,13-15H2