3-[4-(diphenylmethyl)piperazin-1-ium-1-yl]propyl-methyl-azanium

Systemtic Name: 3-[4-(diphenylmethyl)piperazin-1-ium-1-yl]propyl-methyl-azanium Openeye Name: 3-(4-benzhydrylpiperazin-1-ium-1-yl)propyl-methyl-ammonium CAS Name: 3-[4-(diphenylmethyl)-1-piperazin-1-iumyl]propyl-methylammonium IUPAC Name: 3-(4-benzhydrylpiperazin-1-ium-1-yl)propyl-methylazanium Traditional Name: 3-(4-benzhydrylpiperazin-1-ium-1-yl)propyl-methyl-ammonium Formula: C21H31N3+2 MolecularWeight: 325.49094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CCC[NH+]1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH2+]CCC[NH+]1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H29N3/c1-22-13-8-14-23-15-17-24(18-16-23)21(19-9-4-2-5-10-19)20-11-6-3-7-12-20/h2-7,9-12,21-22H,8,13-18H2,1H3/p+2