1-[4-(diphenylmethyl)piperazin-1-yl]-4-(4-methylphenyl)phthalazin-2-ium

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-4-(4-methylphenyl)phthalazin-2-ium Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-4-(p-tolyl)phthalazin-2-ium CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-4-(4-methylphenyl)phthalazin-2-ium IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-4-(4-methylphenyl)phthalazin-2-ium Traditional Name: 1-(4-benzhydrylpiperazino)-4-(p-tolyl)phthalazin-2-ium Formula: C32H31N4+ MolecularWeight: 471.61534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=N[NH+]=C(C3=CC=CC=C32)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)C2=N[NH+]=C(C3=CC=CC=C32)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C32H30N4/c1-24-16-18-25(19-17-24)30-28-14-8-9-15-29(28)32(34-33-30)36-22-20-35(21-23-36)31(26-10-4-2-5-11-26)27-12-6-3-7-13-27/h2-19,31H,20-23H2,1H3/p+1