2-[4-(2-methylsulfonylphenyl)phenyl]-4H-isoquinoline-1,3-dione

Systemtic Name: 2-[4-(2-methylsulfonylphenyl)phenyl]-4H-isoquinoline-1,3-dione Openeye Name: 2-[4-(2-methylsulfonylphenyl)phenyl]-4H-isoquinoline-1,3-dione CAS Name: 2-[4-(2-methylsulfonylphenyl)phenyl]-4H-isoquinoline-1,3-dione IUPAC Name: 2-[4-(2-methylsulfonylphenyl)phenyl]-4H-isoquinoline-1,3-dione Traditional Name: 2-[4-(2-mesylphenyl)phenyl]-4H-isoquinoline-1,3-quinone Formula: C22H17NO4S MolecularWeight: 391.43968

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)N3C(=O)CC4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)N3C(=O)CC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H17NO4S/c1-28(26,27)20-9-5-4-7-18(20)15-10-12-17(13-11-15)23-21(24)14-16-6-2-3-8-19(16)22(23)25/h2-13H,14H2,1H3