4-[5-[(Z)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoic acid

Systemtic Name: 4-[5-[(Z)-2-cyano-3-ethoxy-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoic acid Openeye Name: 4-[5-[(Z)-2-cyano-3-ethoxy-3-oxo-prop-1-enyl]-2-furyl]benzoic acid CAS Name: 4-[5-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]-2-furanyl]benzoic acid IUPAC Name: 4-[5-[(Z)-2-cyano-3-ethoxy-3-oxoprop-1-enyl]furan-2-yl]benzoic acid Traditional Name: 4-[5-[(Z)-2-cyano-3-ethoxy-3-keto-prop-1-enyl]-2-furyl]benzoic acid Formula: C17H13NO5 MolecularWeight: 311.28882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC=C(O1)C2=CC=C(C=C2)C(=O)O)C#N

Isomeric SMILES

CCOC(=O)/C(=C\C1=CC=C(O1)C2=CC=C(C=C2)C(=O)O)/C#N

InChI

InChI=1S/C17H13NO5/c1-2-22-17(21)13(10-18)9-14-7-8-15(23-14)11-3-5-12(6-4-11)16(19)20/h3-9H,2H2,1H3,(H,19,20)/b13-9-