diethyl 4-ethyl-1,2-dimethyl-6-phenyl-pyridin-1-ium-3,5-dicarboxylate

Systemtic Name: diethyl 4-ethyl-1,2-dimethyl-6-phenyl-pyridin-1-ium-3,5-dicarboxylate Openeye Name: diethyl 4-ethyl-1,2-dimethyl-6-phenyl-pyridin-1-ium-3,5-dicarboxylate CAS Name: 4-ethyl-1,2-dimethyl-6-phenylpyridin-1-ium-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-ethyl-1,2-dimethyl-6-phenylpyridin-1-ium-3,5-dicarboxylate Traditional Name: 4-ethyl-1,2-dimethyl-6-phenyl-pyridin-1-ium-3,5-dicarboxylic acid diethyl ester Formula: C21H26NO4+ MolecularWeight: 356.43544

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=[N+](C(=C1C(=O)OCC)C)C)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=[N+](C(=C1C(=O)OCC)C)C)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C21H26NO4/c1-6-16-17(20(23)25-7-2)14(4)22(5)19(15-12-10-9-11-13-15)18(16)21(24)26-8-3/h9-13H,6-8H2,1-5H3/q+1