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

Systemtic Name: 6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-naphthalen-1-yl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(1-naphthyl)-6-[4-(p-tolylsulfonyl)piperazin-1-yl]benzo[de]isoquinoline-1,3-dione CAS Name: 6-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-(1-naphthalenyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-naphthalen-1-ylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(1-naphthyl)-6-(4-tosylpiperazino)benzo[de]isoquinoline-1,3-quinone Formula: C33H27N3O4S MolecularWeight: 561.65018

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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=CC7=CC=CC=C76

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=CC7=CC=CC=C76

InChI

InChI=1S/C33H27N3O4S/c1-22-12-14-24(15-13-22)41(39,40)35-20-18-34(19-21-35)29-17-16-28-31-26(29)9-5-10-27(31)32(37)36(33(28)38)30-11-4-7-23-6-2-3-8-25(23)30/h2-17H,18-21H2,1H3