2-(2-methoxyphenyl)-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(2-methoxyphenyl)-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(2-methoxyphenyl)-6-[4-(p-tolylsulfonyl)piperazin-1-yl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-(2-methoxyphenyl)-6-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(2-methoxyphenyl)-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-(2-methoxyphenyl)-6-(4-tosylpiperazino)benzo[de]isoquinoline-1,3-quinone Formula: C30H27N3O5S MolecularWeight: 541.61748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C4C=CC=C5C4=C(C=C3)C(=O)N(C5=O)C6=CC=CC=C6OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C4C=CC=C5C4=C(C=C3)C(=O)N(C5=O)C6=CC=CC=C6OC

InChI

InChI=1S/C30H27N3O5S/c1-20-10-12-21(13-11-20)39(36,37)32-18-16-31(17-19-32)25-15-14-24-28-22(25)6-5-7-23(28)29(34)33(30(24)35)26-8-3-4-9-27(26)38-2/h3-15H,16-19H2,1-2H3