5-[4-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]phenyl]furan-2-carboxylic acid

Systemtic Name: 5-[4-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]phenyl]furan-2-carboxylic acid Openeye Name: 5-[4-[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]phenyl]furan-2-carboxylic acid CAS Name: 5-[4-[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enyl]phenyl]-2-furancarboxylic acid IUPAC Name: 5-[4-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]phenyl]furan-2-carboxylic acid Traditional Name: 5-[4-[(E)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]phenyl]-2-furoic acid Formula: C21H16O6 MolecularWeight: 364.34814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)C2=CC=C(C=C2)C3=CC=C(O3)C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)C2=CC=C(C=C2)C3=CC=C(O3)C(=O)O)O

InChI

InChI=1S/C21H16O6/c1-26-20-12-13(3-9-17(20)23)2-8-16(22)14-4-6-15(7-5-14)18-10-11-19(27-18)21(24)25/h2-12,23H,1H3,(H,24,25)/b8-2+