ethyl 1-(1-phenylethenyl)pyridin-1-ium-3-carboxylate perchlorate

Systemtic Name: ethyl 1-(1-phenylethenyl)pyridin-1-ium-3-carboxylate perchlorate Openeye Name: ethyl 1-(1-phenylvinyl)pyridin-1-ium-3-carboxylate perchlorate CAS Name: 1-(1-phenylethenyl)-3-pyridin-1-iumcarboxylic acid ethyl ester perchlorate IUPAC Name: ethyl 1-(1-phenylethenyl)pyridin-1-ium-3-carboxylate perchlorate Traditional Name: 1-(1-phenylvinyl)pyridin-1-ium-3-carboxylic acid ethyl ester perchlorate Formula: C16H16ClNO6 MolecularWeight: 353.75434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[N+](=CC=C1)C(=C)C2=CC=CC=C2.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCOC(=O)C1=C[N+](=CC=C1)C(=C)C2=CC=CC=C2.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C16H16NO2.ClHO4/c1-3-19-16(18)15-10-7-11-17(12-15)13(2)14-8-5-4-6-9-14;2-1(3,4)5/h4-12H,2-3H2,1H3;(H,2,3,4,5)/q+1;/p-1