5,6-diacetyloxy-4-hexoxy-6-oxidanyl-3-(4-propan-2-ylphenyl)-5-propyl-cyclohexa-1,3-diene-1-carboxylic acid

Systemtic Name: 5,6-diacetyloxy-4-hexoxy-6-oxidanyl-3-(4-propan-2-ylphenyl)-5-propyl-cyclohexa-1,3-diene-1-carboxylic acid Openeye Name: 5,6-diacetoxy-4-hexoxy-6-hydroxy-3-(4-isopropylphenyl)-5-propyl-cyclohexa-1,3-diene-1-carboxylic acid CAS Name: 5,6-diacetyloxy-4-hexoxy-6-hydroxy-3-(4-propan-2-ylphenyl)-5-propyl-1-cyclohexa-1,3-dienecarboxylic acid IUPAC Name: 5,6-diacetyloxy-4-hexoxy-6-hydroxy-3-(4-propan-2-ylphenyl)-5-propylcyclohexa-1,3-diene-1-carboxylic acid Traditional Name: 5,6-diacetoxy-4-hexoxy-6-hydroxy-3-p-cumenyl-5-propyl-cyclohexa-1,3-diene-1-carboxylic acid Formula: C29H40O8 MolecularWeight: 516.6231

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C(C1(CCC)OC(=O)C)(O)OC(=O)C)C(=O)O)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCCCCCOC1=C(C=C(C(C1(CCC)OC(=O)C)(O)OC(=O)C)C(=O)O)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C29H40O8/c1-7-9-10-11-17-35-26-24(23-14-12-22(13-15-23)19(3)4)18-25(27(32)33)29(34,37-21(6)31)28(26,16-8-2)36-20(5)30/h12-15,18-19,34H,7-11,16-17H2,1-6H3,(H,32,33)