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

Systemtic Name: 4-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butylazanium Openeye Name: 4-[4-(m-tolyl)piperazin-1-ium-1-yl]butylammonium CAS Name: 4-[4-(3-methylphenyl)-1-piperazin-1-iumyl]butylammonium IUPAC Name: 4-[4-(3-methylphenyl)piperazin-1-ium-1-yl]butylazanium Traditional Name: 4-[4-(m-tolyl)piperazin-1-ium-1-yl]butylammonium Formula: C15H27N3+2 MolecularWeight: 249.39498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCCC[NH3+]

Isomeric SMILES

CC1=CC(=CC=C1)N2CC[NH+](CC2)CCCC[NH3+]

InChI

InChI=1S/C15H25N3/c1-14-5-4-6-15(13-14)18-11-9-17(10-12-18)8-3-2-7-16/h4-6,13H,2-3,7-12,16H2,1H3/p+2