2-[4-(4-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-carbonitrile Openeye Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-carbonitrile CAS Name: 2-[4-(4-methoxyphenyl)-1-piperazinyl]-3-pyridin-1-iumcarbonitrile IUPAC Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]pyridin-1-ium-3-carbonitrile Traditional Name: 2-[4-(4-methoxyphenyl)piperazino]pyridin-1-ium-3-carbonitrile Formula: C17H19N4O+ MolecularWeight: 295.35896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C=CC=[NH+]3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C=CC=[NH+]3)C#N

InChI

InChI=1S/C17H18N4O/c1-22-16-6-4-15(5-7-16)20-9-11-21(12-10-20)17-14(13-18)3-2-8-19-17/h2-8H,9-12H2,1H3/p+1