3-(4-methylpiperazin-4-ium-1-yl)propyl-(3-phenylpropyl)azanium

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-(3-phenylpropyl)azanium Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-(3-phenylpropyl)ammonium CAS Name: 3-(4-methyl-1-piperazin-4-iumyl)propyl-(3-phenylpropyl)ammonium IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-(3-phenylpropyl)azanium Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-(3-phenylpropyl)ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCC[NH2+]CCCC2=CC=CC=C2

Isomeric SMILES

C[NH+]1CCN(CC1)CCC[NH2+]CCCC2=CC=CC=C2

InChI

InChI=1S/C17H29N3/c1-19-13-15-20(16-14-19)12-6-11-18-10-5-9-17-7-3-2-4-8-17/h2-4,7-8,18H,5-6,9-16H2,1H3/p+2