3-[4-[3-(4-methylphenyl)propyl]piperazin-4-ium-1-yl]propylazanium

Systemtic Name: 3-[4-[3-(4-methylphenyl)propyl]piperazin-4-ium-1-yl]propylazanium Openeye Name: 3-[4-[3-(p-tolyl)propyl]piperazin-4-ium-1-yl]propylammonium CAS Name: 3-[4-[3-(4-methylphenyl)propyl]-1-piperazin-4-iumyl]propylammonium IUPAC Name: 3-[4-[3-(4-methylphenyl)propyl]piperazin-4-ium-1-yl]propylazanium Traditional Name: 3-[4-[3-(p-tolyl)propyl]piperazin-4-ium-1-yl]propylammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC[NH+]2CCN(CC2)CCC[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)CCC[NH+]2CCN(CC2)CCC[NH3+]

InChI

InChI=1S/C17H29N3/c1-16-5-7-17(8-6-16)4-2-10-19-12-14-20(15-13-19)11-3-9-18/h5-8H,2-4,9-15,18H2,1H3/p+2