3-[(2E)-4-cyano-2-(furan-2-ylmethylidene)-5-oxidanylidene-furan-3-yl]benzoic acid

Systemtic Name: 3-[(2E)-4-cyano-2-(furan-2-ylmethylidene)-5-oxidanylidene-furan-3-yl]benzoic acid Openeye Name: 3-[(2E)-4-cyano-2-(2-furylmethylene)-5-oxo-3-furyl]benzoic acid CAS Name: 3-[(2E)-4-cyano-2-(2-furanylmethylidene)-5-oxo-3-furanyl]benzoic acid IUPAC Name: 3-[(2E)-4-cyano-2-(furan-2-ylmethylidene)-5-oxofuran-3-yl]benzoic acid Traditional Name: 3-[(2E)-4-cyano-2-(2-furfurylidene)-5-keto-3-furyl]benzoic acid Formula: C17H9NO5 MolecularWeight: 307.25706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C2=C(C(=O)OC2=CC3=CC=CO3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C\2=C(C(=O)O/C2=C/C3=CC=CO3)C#N

InChI

InChI=1S/C17H9NO5/c18-9-13-15(10-3-1-4-11(7-10)16(19)20)14(23-17(13)21)8-12-5-2-6-22-12/h1-8H,(H,19,20)/b14-8+