dimethyl-[3-[[4-(phenylmethyl)phthalazin-2-ium-1-yl]amino]propyl]azanium

Systemtic Name: dimethyl-[3-[[4-(phenylmethyl)phthalazin-2-ium-1-yl]amino]propyl]azanium Openeye Name: 3-[(4-benzylphthalazin-2-ium-1-yl)amino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[4-(phenylmethyl)-1-phthalazin-2-iumyl]amino]propyl]ammonium IUPAC Name: 3-[(4-benzylphthalazin-2-ium-1-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(4-benzylphthalazin-2-ium-1-yl)amino]propyl-dimethyl-ammonium Formula: C20H26N4+2 MolecularWeight: 322.44724

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=[NH+]N=C(C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCCNC1=[NH+]N=C(C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N4/c1-24(2)14-8-13-21-20-18-12-7-6-11-17(18)19(22-23-20)15-16-9-4-3-5-10-16/h3-7,9-12H,8,13-15H2,1-2H3,(H,21,23)/p+2