5-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]pentylazanium

Systemtic Name: 5-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]pentylazanium Openeye Name: 5-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]pentylammonium CAS Name: 5-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]pentylammonium IUPAC Name: 5-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]pentylazanium Traditional Name: 5-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]pentylammonium Formula: C16H29N3O+2 MolecularWeight: 279.42096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27N3O/c1-20-16-7-5-15(6-8-16)19-13-11-18(12-14-19)10-4-2-3-9-17/h5-8H,2-4,9-14,17H2,1H3/p+2