3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-mesitylsulfonyl-4-piperidyl)methanone Formula: C24H30N2O3S MolecularWeight: 426.5716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C24H30N2O3S/c1-17-14-18(2)23(19(3)15-17)30(28,29)26-12-9-21(10-13-26)24(27)25-11-8-20-6-4-5-7-22(20)16-25/h4-7,14-15,21H,8-13,16H2,1-3H3