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

Systemtic Name: 1-(phenylmethyl)-4-piperazin-4-ium-1-yl-phthalazine Openeye Name: 1-benzyl-4-piperazin-4-ium-1-yl-phthalazine CAS Name: 1-(phenylmethyl)-4-(1-piperazin-4-iumyl)phthalazine IUPAC Name: 1-benzyl-4-piperazin-4-ium-1-ylphthalazine Traditional Name: 1-benzyl-4-piperazin-4-ium-1-yl-phthalazine Formula: C19H21N4+ MolecularWeight: 305.39684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NN=C(C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NN=C(C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C19H20N4/c1-2-6-15(7-3-1)14-18-16-8-4-5-9-17(16)19(22-21-18)23-12-10-20-11-13-23/h1-9,20H,10-14H2/p+1