3-[2-(4-methylphenyl)sulfonylethyl]-2,3-dihydroisoindol-1-one

Systemtic Name: 3-[2-(4-methylphenyl)sulfonylethyl]-2,3-dihydroisoindol-1-one Openeye Name: 3-[2-(p-tolylsulfonyl)ethyl]isoindolin-1-one CAS Name: 3-[2-(4-methylphenyl)sulfonylethyl]-2,3-dihydroisoindol-1-one IUPAC Name: 3-[2-(4-methylphenyl)sulfonylethyl]-2,3-dihydroisoindol-1-one Traditional Name: 3-(2-tosylethyl)isoindolin-1-one Formula: C17H17NO3S MolecularWeight: 315.38678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC2C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC2C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C17H17NO3S/c1-12-6-8-13(9-7-12)22(20,21)11-10-16-14-4-2-3-5-15(14)17(19)18-16/h2-9,16H,10-11H2,1H3,(H,18,19)