3-methyl-2-(4-methylphenyl)sulfonyl-3H-isoquinoline-1,4-dione

Systemtic Name: 3-methyl-2-(4-methylphenyl)sulfonyl-3H-isoquinoline-1,4-dione Openeye Name: 3-methyl-2-(p-tolylsulfonyl)-3H-isoquinoline-1,4-dione CAS Name: 3-methyl-2-(4-methylphenyl)sulfonyl-3H-isoquinoline-1,4-dione IUPAC Name: 3-methyl-2-(4-methylphenyl)sulfonyl-3H-isoquinoline-1,4-dione Traditional Name: 3-methyl-2-tosyl-3H-isoquinoline-1,4-quinone Formula: C17H15NO4S MolecularWeight: 329.3703

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)C2=CC=CC=C2C(=O)N1S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1C(=O)C2=CC=CC=C2C(=O)N1S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C17H15NO4S/c1-11-7-9-13(10-8-11)23(21,22)18-12(2)16(19)14-5-3-4-6-15(14)17(18)20/h3-10,12H,1-2H3