4-[1-(3,4-dimethoxyphenyl)piperazin-1-ium-1-yl]pyridin-3-amine

Systemtic Name: 4-[1-(3,4-dimethoxyphenyl)piperazin-1-ium-1-yl]pyridin-3-amine Openeye Name: 4-[1-(3,4-dimethoxyphenyl)piperazin-1-ium-1-yl]pyridin-3-amine CAS Name: 4-[1-(3,4-dimethoxyphenyl)-1-piperazin-1-iumyl]-3-pyridinamine IUPAC Name: 4-[1-(3,4-dimethoxyphenyl)piperazin-1-ium-1-yl]pyridin-3-amine Traditional Name: [4-[1-(3,4-dimethoxyphenyl)piperazin-1-ium-1-yl]-3-pyridyl]amine Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+]2(CCNCC2)C3=C(C=NC=C3)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[N+]2(CCNCC2)C3=C(C=NC=C3)N)OC

InChI

InChI=1S/C17H23N4O2/c1-22-16-4-3-13(11-17(16)23-2)21(9-7-19-8-10-21)15-5-6-20-12-14(15)18/h3-6,11-12,19H,7-10,18H2,1-2H3/q+1