2-[4-[3-(3-methylphenyl)propyl]piperazin-4-ium-1-yl]ethylazanium

Systemtic Name: 2-[4-[3-(3-methylphenyl)propyl]piperazin-4-ium-1-yl]ethylazanium Openeye Name: 2-[4-[3-(m-tolyl)propyl]piperazin-4-ium-1-yl]ethylammonium CAS Name: 2-[4-[3-(3-methylphenyl)propyl]-1-piperazin-4-iumyl]ethylammonium IUPAC Name: 2-[4-[3-(3-methylphenyl)propyl]piperazin-4-ium-1-yl]ethylazanium Traditional Name: 2-[4-[3-(m-tolyl)propyl]piperazin-4-ium-1-yl]ethylammonium Formula: C16H29N3+2 MolecularWeight: 263.42156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N3/c1-15-4-2-5-16(14-15)6-3-8-18-10-12-19(9-7-17)13-11-18/h2,4-5,14H,3,6-13,17H2,1H3/p+2