5-[(E)-3-(2-carboxyphenyl)prop-2-enoyl]-2-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 5-[(E)-3-(2-carboxyphenyl)prop-2-enoyl]-2-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 5-[(E)-3-(2-carboxyphenyl)prop-2-enoyl]-2-[(E)-3-hydroxy-3-oxo-prop-1-enyl]benzoic acid CAS Name: 5-[(E)-3-(2-carboxyphenyl)-1-oxoprop-2-enyl]-2-[(E)-3-hydroxy-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 5-[(E)-3-(2-carboxyphenyl)prop-2-enoyl]-2-[(E)-3-hydroxy-3-oxoprop-1-enyl]benzoic acid Traditional Name: 5-[(E)-3-(2-carboxyphenyl)acryloyl]-2-[(E)-3-hydroxy-3-keto-prop-1-enyl]benzoic acid Formula: C20H14O7 MolecularWeight: 366.32096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)C2=CC(=C(C=C2)C=CC(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C(=O)C2=CC(=C(C=C2)/C=C/C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C20H14O7/c21-17(9-7-12-3-1-2-4-15(12)19(24)25)14-6-5-13(8-10-18(22)23)16(11-14)20(26)27/h1-11H,(H,22,23)(H,24,25)(H,26,27)/b9-7+,10-8+