(2E)-2-(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1H-pyridine-4-carboxylic acid

Systemtic Name: (2E)-2-(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-1H-pyridine-4-carboxylic acid Openeye Name: (2E)-2-(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)-1H-pyridine-4-carboxylic acid CAS Name: (2E)-2-(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyridine-4-carboxylic acid IUPAC Name: (2E)-2-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyridine-4-carboxylic acid Traditional Name: (2E)-2-(3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)-1H-pyridine-4-carboxylic acid Formula: C12H8ClNO3 MolecularWeight: 249.64982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=C2C=C(C=CN2)C(=O)O)C=C1Cl

Isomeric SMILES

C1=CC(=O)/C(=C/2\C=C(C=CN2)C(=O)O)/C=C1Cl

InChI

InChI=1S/C12H8ClNO3/c13-8-1-2-11(15)9(6-8)10-5-7(12(16)17)3-4-14-10/h1-6,14H,(H,16,17)/b10-9+