2-methyl-3-[2-(4-methylphenyl)sulfonylethyl]-3H-isoindol-1-one

Systemtic Name: 2-methyl-3-[2-(4-methylphenyl)sulfonylethyl]-3H-isoindol-1-one Openeye Name: 2-methyl-3-[2-(p-tolylsulfonyl)ethyl]isoindolin-1-one CAS Name: 2-methyl-3-[2-(4-methylphenyl)sulfonylethyl]-3H-isoindol-1-one IUPAC Name: 2-methyl-3-[2-(4-methylphenyl)sulfonylethyl]-3H-isoindol-1-one Traditional Name: 2-methyl-3-(2-tosylethyl)isoindolin-1-one Formula: C18H19NO3S MolecularWeight: 329.41336

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)N2C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC2C3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C18H19NO3S/c1-13-7-9-14(10-8-13)23(21,22)12-11-17-15-5-3-4-6-16(15)18(20)19(17)2/h3-10,17H,11-12H2,1-2H3