3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-phenylpropylsulfonyl)piperidin-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-phenylpropylsulfonyl)piperidin-3-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-phenylpropylsulfonyl)-3-piperidyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-phenylpropylsulfonyl)-3-piperidinyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-phenylpropylsulfonyl)piperidin-3-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(3-phenylpropylsulfonyl)-3-piperidyl]methanone Formula: C24H30N2O3S MolecularWeight: 426.5716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H30N2O3S/c27-24(25-16-14-21-11-4-5-12-22(21)18-25)23-13-6-15-26(19-23)30(28,29)17-7-10-20-8-2-1-3-9-20/h1-5,8-9,11-12,23H,6-7,10,13-19H2