[3,4-diethoxy-2-(4-fluorophenyl)-6-propan-2-yl-phenyl] 5-oxidanyl-3-oxidanylidene-hept-6-enoate

Systemtic Name: [3,4-diethoxy-2-(4-fluorophenyl)-6-propan-2-yl-phenyl] 5-oxidanyl-3-oxidanylidene-hept-6-enoate Openeye Name: [3,4-diethoxy-2-(4-fluorophenyl)-6-isopropyl-phenyl] 5-hydroxy-3-oxo-hept-6-enoate CAS Name: 5-hydroxy-3-oxo-6-heptenoic acid [3,4-diethoxy-2-(4-fluorophenyl)-6-propan-2-ylphenyl] ester IUPAC Name: [3,4-diethoxy-2-(4-fluorophenyl)-6-propan-2-ylphenyl] 5-hydroxy-3-oxohept-6-enoate Traditional Name: 5-hydroxy-3-keto-hept-6-enoic acid [3,4-diethoxy-2-(4-fluorophenyl)-6-isopropyl-phenyl] ester Formula: C26H31FO6 MolecularWeight: 458.519143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C(=C1)C(C)C)OC(=O)CC(=O)CC(C=C)O)C2=CC=C(C=C2)F)OCC

Isomeric SMILES

CCOC1=C(C(=C(C(=C1)C(C)C)OC(=O)CC(=O)CC(C=C)O)C2=CC=C(C=C2)F)OCC

InChI

InChI=1S/C26H31FO6/c1-6-19(28)13-20(29)14-23(30)33-25-21(16(4)5)15-22(31-7-2)26(32-8-3)24(25)17-9-11-18(27)12-10-17/h6,9-12,15-16,19,28H,1,7-8,13-14H2,2-5H3