2-naphthalen-1-yl-6-piperazin-4-ium-1-yl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-naphthalen-1-yl-6-piperazin-4-ium-1-yl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(1-naphthyl)-6-piperazin-4-ium-1-yl-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(1-naphthalenyl)-6-(1-piperazin-4-iumyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-naphthalen-1-yl-6-piperazin-4-ium-1-ylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(1-naphthyl)-6-piperazin-4-ium-1-yl-benzo[de]isoquinoline-1,3-quinone Formula: C26H22N3O2+ MolecularWeight: 408.47178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1CN(CC[NH2+]1)C2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C26H21N3O2/c30-25-20-9-4-8-19-22(28-15-13-27-14-16-28)12-11-21(24(19)20)26(31)29(25)23-10-3-6-17-5-1-2-7-18(17)23/h1-12,27H,13-16H2/p+1