5-[4-(diphenylmethyl)piperazin-1-yl]-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one

Systemtic Name: 5-[4-(diphenylmethyl)piperazin-1-yl]-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Openeye Name: 5-(4-benzhydrylpiperazin-1-yl)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one CAS Name: 5-[4-(diphenylmethyl)-1-piperazinyl]-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one IUPAC Name: 5-(4-benzhydrylpiperazin-1-yl)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Traditional Name: 5-(4-benzhydrylpiperazino)-13H-quinazolino[2,3-a]phthalazin-7-ium-8-one Formula: C32H28N5O+ MolecularWeight: 498.59762

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=N[N+]3=C(C4=CC=CC=C42)NC5=CC=CC=C5C3=O)C(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

C1CN(CCN1C2=N[N+]3=C(C4=CC=CC=C42)NC5=CC=CC=C5C3=O)C(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C32H27N5O/c38-32-27-17-9-10-18-28(27)33-30-25-15-7-8-16-26(25)31(34-37(30)32)36-21-19-35(20-22-36)29(23-11-3-1-4-12-23)24-13-5-2-6-14-24/h1-18,29H,19-22H2/p+1