ethyl 3,5-dimethyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 3,5-dimethyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[(E)-2-(1-methyl-4-pyridin-1-iumyl)ethenyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1H-pyrrole-2-carboxylate Traditional Name: 3,5-dimethyl-4-[(E)-2-(1-methylpyridin-1-ium-4-yl)vinyl]-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C17H21N2O2+ MolecularWeight: 285.36084

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C=CC2=CC=[N+](C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)/C=C/C2=CC=[N+](C=C2)C)C

InChI

InChI=1S/C17H20N2O2/c1-5-21-17(20)16-12(2)15(13(3)18-16)7-6-14-8-10-19(4)11-9-14/h6-11H,5H2,1-4H3/p+1