[2,2-diethyl-4-(4-fluorophenyl)chromen-3-yl] 3,5-bis(oxidanyl)hept-6-enoate

Systemtic Name: [2,2-diethyl-4-(4-fluorophenyl)chromen-3-yl] 3,5-bis(oxidanyl)hept-6-enoate Openeye Name: [2,2-diethyl-4-(4-fluorophenyl)chromen-3-yl] 3,5-dihydroxyhept-6-enoate CAS Name: 3,5-dihydroxy-6-heptenoic acid [2,2-diethyl-4-(4-fluorophenyl)-1-benzopyran-3-yl] ester IUPAC Name: [2,2-diethyl-4-(4-fluorophenyl)chromen-3-yl] 3,5-dihydroxyhept-6-enoate Traditional Name: 3,5-dihydroxyhept-6-enoic acid [2,2-diethyl-4-(4-fluorophenyl)chromen-3-yl] ester Formula: C26H29FO5 MolecularWeight: 440.503863

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=C(C2=CC=CC=C2O1)C3=CC=C(C=C3)F)OC(=O)CC(CC(C=C)O)O)CC

Isomeric SMILES

CCC1(C(=C(C2=CC=CC=C2O1)C3=CC=C(C=C3)F)OC(=O)CC(CC(C=C)O)O)CC

InChI

InChI=1S/C26H29FO5/c1-4-19(28)15-20(29)16-23(30)31-25-24(17-11-13-18(27)14-12-17)21-9-7-8-10-22(21)32-26(25,5-2)6-3/h4,7-14,19-20,28-29H,1,5-6,15-16H2,2-3H3