5,6-diethyl-4,7-dimethyl-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindole

Systemtic Name: 5,6-diethyl-4,7-dimethyl-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindole Openeye Name: 5,6-diethyl-4,7-dimethyl-2-(p-tolylsulfonyl)isoindoline CAS Name: 5,6-diethyl-4,7-dimethyl-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindole IUPAC Name: 5,6-diethyl-4,7-dimethyl-2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindole Traditional Name: 5,6-diethyl-4,7-dimethyl-2-tosyl-isoindoline Formula: C21H27NO2S MolecularWeight: 357.50958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(CN(C2)S(=O)(=O)C3=CC=C(C=C3)C)C(=C1CC)C)C

Isomeric SMILES

CCC1=C(C2=C(CN(C2)S(=O)(=O)C3=CC=C(C=C3)C)C(=C1CC)C)C

InChI

InChI=1S/C21H27NO2S/c1-6-18-15(4)20-12-22(13-21(20)16(5)19(18)7-2)25(23,24)17-10-8-14(3)9-11-17/h8-11H,6-7,12-13H2,1-5H3