ethyl 5-cyano-6-(dimethylamino)-2-phenyl-pyridin-1-ium-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-(dimethylamino)-2-phenyl-pyridin-1-ium-3-carboxylate Openeye Name: ethyl 5-cyano-6-(dimethylamino)-2-phenyl-pyridin-1-ium-3-carboxylate CAS Name: 5-cyano-6-(dimethylamino)-2-phenyl-3-pyridin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-(dimethylamino)-2-phenylpyridin-1-ium-3-carboxylate Traditional Name: 5-cyano-6-(dimethylamino)-2-phenyl-pyridin-1-ium-3-carboxylic acid ethyl ester Formula: C17H18N3O2+ MolecularWeight: 296.34372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C([NH+]=C(C(=C1)C#N)N(C)C)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C([NH+]=C(C(=C1)C#N)N(C)C)C2=CC=CC=C2

InChI

InChI=1S/C17H17N3O2/c1-4-22-17(21)14-10-13(11-18)16(20(2)3)19-15(14)12-8-6-5-7-9-12/h5-10H,4H2,1-3H3/p+1