5-[(E)-5-(3-methoxy-4-oxidanyl-phenyl)-3-oxidanylidene-pent-4-enyl]furan-2-carboxylic acid

Systemtic Name: 5-[(E)-5-(3-methoxy-4-oxidanyl-phenyl)-3-oxidanylidene-pent-4-enyl]furan-2-carboxylic acid Openeye Name: 5-[(E)-5-(4-hydroxy-3-methoxy-phenyl)-3-oxo-pent-4-enyl]furan-2-carboxylic acid CAS Name: 5-[(E)-5-(4-hydroxy-3-methoxyphenyl)-3-oxopent-4-enyl]-2-furancarboxylic acid IUPAC Name: 5-[(E)-5-(4-hydroxy-3-methoxyphenyl)-3-oxopent-4-enyl]furan-2-carboxylic acid Traditional Name: 5-[(E)-5-(4-hydroxy-3-methoxy-phenyl)-3-keto-pent-4-enyl]-2-furoic acid Formula: C17H16O6 MolecularWeight: 316.30534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)CCC2=CC=C(O2)C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)CCC2=CC=C(O2)C(=O)O)O

InChI

InChI=1S/C17H16O6/c1-22-16-10-11(3-8-14(16)19)2-4-12(18)5-6-13-7-9-15(23-13)17(20)21/h2-4,7-10,19H,5-6H2,1H3,(H,20,21)/b4-2+