2-(2,4,6-trimethylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(2,4,6-trimethylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(2,4,6-trimethylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline CAS Name: 2-(2,4,6-trimethylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(2,4,6-trimethylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-mesitylsulfonyl-3,4-dihydro-1H-isoquinoline Formula: C18H21NO2S MolecularWeight: 315.42984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC3=CC=CC=C3C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C18H21NO2S/c1-13-10-14(2)18(15(3)11-13)22(20,21)19-9-8-16-6-4-5-7-17(16)12-19/h4-7,10-11H,8-9,12H2,1-3H3