(2E)-4-oxidanyl-3-oxidanylidene-2-(1H-pyridin-2-ylidene)heptanoic acid

Systemtic Name: (2E)-4-oxidanyl-3-oxidanylidene-2-(1H-pyridin-2-ylidene)heptanoic acid Openeye Name: (2E)-4-hydroxy-3-oxo-2-(1H-pyridin-2-ylidene)heptanoic acid CAS Name: (2E)-4-hydroxy-3-oxo-2-(1H-pyridin-2-ylidene)heptanoic acid IUPAC Name: (2E)-4-hydroxy-3-oxo-2-(1H-pyridin-2-ylidene)heptanoic acid Traditional Name: (2E)-4-hydroxy-3-keto-2-(1H-pyridin-2-ylidene)enanthic acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C(=C1C=CC=CN1)C(=O)O)O

Isomeric SMILES

CCCC(C(=O)/C(=C\1/C=CC=CN1)/C(=O)O)O

InChI

InChI=1S/C12H15NO4/c1-2-5-9(14)11(15)10(12(16)17)8-6-3-4-7-13-8/h3-4,6-7,9,13-14H,2,5H2,1H3,(H,16,17)/b10-8+