3-[4-[2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]propylazanium

Systemtic Name: 3-[4-[2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]propylazanium Openeye Name: 3-[4-[2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]propylammonium CAS Name: 3-[4-[2-(4-methoxyphenyl)ethyl]-1-piperazin-4-iumyl]propylammonium IUPAC Name: 3-[4-[2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]propylazanium Traditional Name: 3-[4-[2-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]propylammonium Formula: C16H29N3O+2 MolecularWeight: 279.42096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC[NH+]2CCN(CC2)CCC[NH3+]

Isomeric SMILES

COC1=CC=C(C=C1)CC[NH+]2CCN(CC2)CCC[NH3+]

InChI

InChI=1S/C16H27N3O/c1-20-16-5-3-15(4-6-16)7-10-19-13-11-18(12-14-19)9-2-8-17/h3-6H,2,7-14,17H2,1H3/p+2