(3E)-4-oxidanylidene-3-[(2-oxidanylidene-1H-pyridin-3-yl)methylidene]pentanoic acid

Systemtic Name: (3E)-4-oxidanylidene-3-[(2-oxidanylidene-1H-pyridin-3-yl)methylidene]pentanoic acid Openeye Name: (3E)-4-oxo-3-[(2-oxo-1H-pyridin-3-yl)methylene]pentanoic acid CAS Name: (3E)-4-oxo-3-[(2-oxo-1H-pyridin-3-yl)methylidene]pentanoic acid IUPAC Name: (3E)-4-oxo-3-[(2-oxo-1H-pyridin-3-yl)methylidene]pentanoic acid Traditional Name: (E)-3-acetyl-4-(2-keto-1H-pyridin-3-yl)but-3-enoic acid Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CNC1=O)CC(=O)O

Isomeric SMILES

CC(=O)/C(=C/C1=CC=CNC1=O)/CC(=O)O

InChI

InChI=1S/C11H11NO4/c1-7(13)9(6-10(14)15)5-8-3-2-4-12-11(8)16/h2-5H,6H2,1H3,(H,12,16)(H,14,15)/b9-5+