5-(4-chlorophenyl)sulfonyl-2-(2-methylphenyl)isoindole-1,3-dione

Systemtic Name: 5-(4-chlorophenyl)sulfonyl-2-(2-methylphenyl)isoindole-1,3-dione Openeye Name: 5-(4-chlorophenyl)sulfonyl-2-(o-tolyl)isoindoline-1,3-dione CAS Name: 5-(4-chlorophenyl)sulfonyl-2-(2-methylphenyl)isoindole-1,3-dione IUPAC Name: 5-(4-chlorophenyl)sulfonyl-2-(2-methylphenyl)isoindole-1,3-dione Traditional Name: 5-(4-chlorophenyl)sulfonyl-2-(o-tolyl)isoindoline-1,3-quinone Formula: C21H14ClNO4S MolecularWeight: 411.85816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14ClNO4S/c1-13-4-2-3-5-19(13)23-20(24)17-11-10-16(12-18(17)21(23)25)28(26,27)15-8-6-14(22)7-9-15/h2-12H,1H3