2-[methyl(phenyl)amino]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[methyl(phenyl)amino]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(N-methylanilino)-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone CAS Name: 2-(N-methylanilino)-1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2-(N-methylanilino)-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-(N-methylanilino)-1-(4-pyridin-1-ium-2-ylpiperazino)ethanone Formula: C18H23N4O+ MolecularWeight: 311.40142

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)C2=CC=CC=[NH+]2)C3=CC=CC=C3

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)C2=CC=CC=[NH+]2)C3=CC=CC=C3

InChI

InChI=1S/C18H22N4O/c1-20(16-7-3-2-4-8-16)15-18(23)22-13-11-21(12-14-22)17-9-5-6-10-19-17/h2-10H,11-15H2,1H3/p+1