1-hexyl-4-(2-methylphenyl)piperazin-1-ium

Systemtic Name: 1-hexyl-4-(2-methylphenyl)piperazin-1-ium Openeye Name: 1-hexyl-4-(o-tolyl)piperazin-1-ium CAS Name: 1-hexyl-4-(2-methylphenyl)piperazin-1-ium IUPAC Name: 1-hexyl-4-(2-methylphenyl)piperazin-1-ium Traditional Name: 1-hexyl-4-(o-tolyl)piperazin-1-ium Formula: C17H29N2+ MolecularWeight: 261.42556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[NH+]1CCN(CC1)C2=CC=CC=C2C

Isomeric SMILES

CCCCCC[NH+]1CCN(CC1)C2=CC=CC=C2C

InChI

InChI=1S/C17H28N2/c1-3-4-5-8-11-18-12-14-19(15-13-18)17-10-7-6-9-16(17)2/h6-7,9-10H,3-5,8,11-15H2,1-2H3/p+1