4-(methoxymethyl)-6-methyl-2-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carbonitrile

Systemtic Name: 4-(methoxymethyl)-6-methyl-2-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carbonitrile Openeye Name: 4-(methoxymethyl)-6-methyl-2-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carbonitrile CAS Name: 4-(methoxymethyl)-6-methyl-2-(4-phenyl-1-piperazinyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 4-(methoxymethyl)-6-methyl-2-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carbonitrile Traditional Name: 4-(methoxymethyl)-6-methyl-2-(4-phenylpiperazino)pyridin-1-ium-3-carbonitrile Formula: C19H23N4O+ MolecularWeight: 323.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=C(C(=C1)COC)C#N)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=[NH+]C(=C(C(=C1)COC)C#N)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H22N4O/c1-15-12-16(14-24-2)18(13-20)19(21-15)23-10-8-22(9-11-23)17-6-4-3-5-7-17/h3-7,12H,8-11,14H2,1-2H3/p+1