5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-3,4-bis(oxidanyl)cyclohexene-1-carboxylic acid

Systemtic Name: 5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-3,4-bis(oxidanyl)cyclohexene-1-carboxylic acid Openeye Name: 3,4-dihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-cyclohexene-1-carboxylic acid CAS Name: 3,4-dihydroxy-5-[(E)-3-(4-hydroxyphenyl)-1-oxoprop-2-enoxy]-1-cyclohexenecarboxylic acid IUPAC Name: 3,4-dihydroxy-5-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxycyclohexene-1-carboxylic acid Traditional Name: 3,4-dihydroxy-5-[(E)-3-(4-hydroxyphenyl)acryloyl]oxy-cyclohexene-1-carboxylic acid Formula: C16H16O7 MolecularWeight: 320.29404

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C=C1C(=O)O)O)O)OC(=O)C=CC2=CC=C(C=C2)O

Isomeric SMILES

C1C(C(C(C=C1C(=O)O)O)O)OC(=O)/C=C/C2=CC=C(C=C2)O

InChI

InChI=1S/C16H16O7/c17-11-4-1-9(2-5-11)3-6-14(19)23-13-8-10(16(21)22)7-12(18)15(13)20/h1-7,12-13,15,17-18,20H,8H2,(H,21,22)/b6-3+