1-[2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-(2,4-dimethylphenyl)-2-oxo-ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-(2,4-dimethylphenyl)-2-oxoethyl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[2-(2,4-dimethylphenyl)-2-keto-ethyl]pyridin-1-ium-3-carboxamide Formula: C16H17N2O2+ MolecularWeight: 269.31838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)C(=O)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)C(=O)N)C

InChI

InChI=1S/C16H16N2O2/c1-11-5-6-14(12(2)8-11)15(19)10-18-7-3-4-13(9-18)16(17)20/h3-9H,10H2,1-2H3,(H-,17,20)/p+1