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

Systemtic Name: 2-(4-methylphenyl)sulfonyl-4-phenyl-4H-isoquinoline-1,3-dione Openeye Name: 4-phenyl-2-(p-tolylsulfonyl)-4H-isoquinoline-1,3-dione CAS Name: 2-(4-methylphenyl)sulfonyl-4-phenyl-4H-isoquinoline-1,3-dione IUPAC Name: 2-(4-methylphenyl)sulfonyl-4-phenyl-4H-isoquinoline-1,3-dione Traditional Name: 4-phenyl-2-tosyl-4H-isoquinoline-1,3-quinone Formula: C22H17NO4S MolecularWeight: 391.43968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=O)C(C3=CC=CC=C3C2=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=O)C(C3=CC=CC=C3C2=O)C4=CC=CC=C4

InChI

InChI=1S/C22H17NO4S/c1-15-11-13-17(14-12-15)28(26,27)23-21(24)19-10-6-5-9-18(19)20(22(23)25)16-7-3-2-4-8-16/h2-14,20H,1H3