1-(phenylmethyl)-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phthalazine

Systemtic Name: 1-(phenylmethyl)-4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phthalazine Openeye Name: 1-benzyl-4-(4-benzylpiperazin-4-ium-1-yl)phthalazine CAS Name: 1-(phenylmethyl)-4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phthalazine IUPAC Name: 1-benzyl-4-(4-benzylpiperazin-4-ium-1-yl)phthalazine Traditional Name: 1-benzyl-4-(4-benzylpiperazin-4-ium-1-yl)phthalazine Formula: C26H27N4+ MolecularWeight: 395.51938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C26H26N4/c1-3-9-21(10-4-1)19-25-23-13-7-8-14-24(23)26(28-27-25)30-17-15-29(16-18-30)20-22-11-5-2-6-12-22/h1-14H,15-20H2/p+1