3,4-dihydro-1H-isoquinolin-2-yl-[1-(phenylmethyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(phenylmethyl)sulfonylpiperidin-4-yl]methanone Openeye Name: (1-benzylsulfonyl-4-piperidyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(phenylmethyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: (1-benzylsulfonylpiperidin-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (1-benzylsulfonyl-4-piperidyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C22H26N2O3S MolecularWeight: 398.51844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H26N2O3S/c25-22(23-13-10-19-8-4-5-9-21(19)16-23)20-11-14-24(15-12-20)28(26,27)17-18-6-2-1-3-7-18/h1-9,20H,10-17H2