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

Systemtic Name: N-methyl-4-(4-phenylpiperazin-1-yl)pyridin-1-ium-2-carboxamide Openeye Name: N-methyl-4-(4-phenylpiperazin-1-yl)pyridin-1-ium-2-carboxamide CAS Name: N-methyl-4-(4-phenyl-1-piperazinyl)-2-pyridin-1-iumcarboxamide IUPAC Name: N-methyl-4-(4-phenylpiperazin-1-yl)pyridin-1-ium-2-carboxamide Traditional Name: N-methyl-4-(4-phenylpiperazino)pyridin-1-ium-2-carboxamide Formula: C17H21N4O+ MolecularWeight: 297.37484

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=[NH+]C=CC(=C1)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1=[NH+]C=CC(=C1)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O/c1-18-17(22)16-13-15(7-8-19-16)21-11-9-20(10-12-21)14-5-3-2-4-6-14/h2-8,13H,9-12H2,1H3,(H,18,22)/p+1