(2E)-3-oxidanylidene-2-(pyridin-2-ylmethylidene)butanoic acid

Systemtic Name: (2E)-3-oxidanylidene-2-(pyridin-2-ylmethylidene)butanoic acid Openeye Name: (2E)-3-oxo-2-(2-pyridylmethylene)butanoic acid CAS Name: (2E)-3-oxo-2-(2-pyridinylmethylidene)butanoic acid IUPAC Name: (2E)-3-oxo-2-(pyridin-2-ylmethylidene)butanoic acid Traditional Name: (E)-2-acetyl-3-(2-pyridyl)acrylic acid Formula: C10H9NO3 MolecularWeight: 191.18336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CC=N1)C(=O)O

Isomeric SMILES

CC(=O)/C(=C\C1=CC=CC=N1)/C(=O)O

InChI

InChI=1S/C10H9NO3/c1-7(12)9(10(13)14)6-8-4-2-3-5-11-8/h2-6H,1H3,(H,13,14)/b9-6+