N-methyl-N-(4-methylphenyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide

Systemtic Name: N-methyl-N-(4-methylphenyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide Openeye Name: N-methyl-N-(p-tolyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide CAS Name: N-methyl-N-(4-methylphenyl)-4-(2-pyridin-1-iumyl)-1-piperazinecarboxamide IUPAC Name: N-methyl-N-(4-methylphenyl)-4-pyridin-1-ium-2-ylpiperazine-1-carboxamide Traditional Name: N-methyl-N-(p-tolyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide Formula: C18H23N4O+ MolecularWeight: 311.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C)C(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CC1=CC=C(C=C1)N(C)C(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C18H22N4O/c1-15-6-8-16(9-7-15)20(2)18(23)22-13-11-21(12-14-22)17-5-3-4-10-19-17/h3-10H,11-14H2,1-2H3/p+1