5-[(E)-2-(4-carboxy-3-oxidanyl-phenyl)ethenyl]-3-(furan-2-yl)-2-methoxy-benzoic acid

Systemtic Name: 5-[(E)-2-(4-carboxy-3-oxidanyl-phenyl)ethenyl]-3-(furan-2-yl)-2-methoxy-benzoic acid Openeye Name: 5-[(E)-2-(4-carboxy-3-hydroxy-phenyl)vinyl]-3-(2-furyl)-2-methoxy-benzoic acid CAS Name: 5-[(E)-2-(4-carboxy-3-hydroxyphenyl)ethenyl]-3-(2-furanyl)-2-methoxybenzoic acid IUPAC Name: 5-[(E)-2-(4-carboxy-3-hydroxyphenyl)ethenyl]-3-(furan-2-yl)-2-methoxybenzoic acid Traditional Name: 5-[(E)-2-(4-carboxy-3-hydroxy-phenyl)vinyl]-3-(2-furyl)-2-methoxy-benzoic acid Formula: C21H16O7 MolecularWeight: 380.34754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C2=CC=CO2)C=CC3=CC(=C(C=C3)C(=O)O)O)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1C2=CC=CO2)/C=C/C3=CC(=C(C=C3)C(=O)O)O)C(=O)O

InChI

InChI=1S/C21H16O7/c1-27-19-15(18-3-2-8-28-18)9-13(10-16(19)21(25)26)5-4-12-6-7-14(20(23)24)17(22)11-12/h2-11,22H,1H3,(H,23,24)(H,25,26)/b5-4+