6-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]hexylazanium

Systemtic Name: 6-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]hexylazanium Openeye Name: 6-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]hexylammonium CAS Name: 6-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]hexylammonium IUPAC Name: 6-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]hexylazanium Traditional Name: 6-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]hexylammonium Formula: C17H31N3O+2 MolecularWeight: 293.44754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)CCCCCC[NH3+]

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)CCCCCC[NH3+]

InChI

InChI=1S/C17H29N3O/c1-21-17-8-6-7-16(15-17)20-13-11-19(12-14-20)10-5-3-2-4-9-18/h6-8,15H,2-5,9-14,18H2,1H3/p+2