1-(2,5-dimethoxyphenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine

Systemtic Name: 1-(2,5-dimethoxyphenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine Openeye Name: 1-(2,5-dimethoxyphenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine CAS Name: 1-(2,5-dimethoxyphenyl)-N-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanimine IUPAC Name: 1-(2,5-dimethoxyphenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine Traditional Name: (E)-(2,5-dimethoxybenzylidene)-(4-pyridin-1-ium-2-ylpiperazino)amine Formula: C18H23N4O2+ MolecularWeight: 327.40082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C=NN2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O2/c1-23-16-6-7-17(24-2)15(13-16)14-20-22-11-9-21(10-12-22)18-5-3-4-8-19-18/h3-8,13-14H,9-12H2,1-2H3/p+1/b20-14+