(2E)-2-(pyridin-4-ylmethylidene)butanoate

Systemtic Name: (2E)-2-(pyridin-4-ylmethylidene)butanoate Openeye Name: (2E)-2-(4-pyridylmethylene)butanoate CAS Name: (2E)-2-(pyridin-4-ylmethylidene)butanoate IUPAC Name: (2E)-2-(pyridin-4-ylmethylidene)butanoate Traditional Name: (E)-2-ethyl-3-(4-pyridyl)acrylate Formula: C10H10NO2- MolecularWeight: 176.1919

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC1=CC=NC=C1)C(=O)[O-]

Isomeric SMILES

CC/C(=C\C1=CC=NC=C1)/C(=O)[O-]

InChI

InChI=1S/C10H11NO2/c1-2-9(10(12)13)7-8-3-5-11-6-4-8/h3-7H,2H2,1H3,(H,12,13)/p-1/b9-7+