2,6-dimethyl-4-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carboxamide

Systemtic Name: 2,6-dimethyl-4-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carboxamide Openeye Name: 2,6-dimethyl-4-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carboxamide CAS Name: 2,6-dimethyl-4-(4-phenyl-1-piperazinyl)-3-pyridin-1-iumcarboxamide IUPAC Name: 2,6-dimethyl-4-(4-phenylpiperazin-1-yl)pyridin-1-ium-3-carboxamide Traditional Name: 2,6-dimethyl-4-(4-phenylpiperazino)pyridin-1-ium-3-carboxamide Formula: C18H23N4O+ MolecularWeight: 311.40142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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