[5-[2,4-bis(2-ethoxy-2-oxidanylidene-ethyl)-6-oxidanylidene-cyclohexyl]-2,4-dimethoxy-phenyl] benzoate

Systemtic Name: [5-[2,4-bis(2-ethoxy-2-oxidanylidene-ethyl)-6-oxidanylidene-cyclohexyl]-2,4-dimethoxy-phenyl] benzoate Openeye Name: [5-[2,4-bis(2-ethoxy-2-oxo-ethyl)-6-oxo-cyclohexyl]-2,4-dimethoxy-phenyl] benzoate CAS Name: benzoic acid [5-[2,4-bis(2-ethoxy-2-oxoethyl)-6-oxocyclohexyl]-2,4-dimethoxyphenyl] ester IUPAC Name: [5-[2,4-bis(2-ethoxy-2-oxoethyl)-6-oxocyclohexyl]-2,4-dimethoxyphenyl] benzoate Traditional Name: benzoic acid [5-[2,4-bis(2-ethoxy-2-keto-ethyl)-6-keto-cyclohexyl]-2,4-dimethoxy-phenyl] ester Formula: C29H34O9 MolecularWeight: 526.57486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CC(C(C(=O)C1)C2=CC(=C(C=C2OC)OC)OC(=O)C3=CC=CC=C3)CC(=O)OCC

Isomeric SMILES

CCOC(=O)CC1CC(C(C(=O)C1)C2=CC(=C(C=C2OC)OC)OC(=O)C3=CC=CC=C3)CC(=O)OCC

InChI

InChI=1S/C29H34O9/c1-5-36-26(31)14-18-12-20(15-27(32)37-6-2)28(22(30)13-18)21-16-25(24(35-4)17-23(21)34-3)38-29(33)19-10-8-7-9-11-19/h7-11,16-18,20,28H,5-6,12-15H2,1-4H3