5-fluoranyl-1-heptan-4-yl-4-hexanoyloxy-cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: 5-fluoranyl-1-heptan-4-yl-4-hexanoyloxy-cyclohexa-2,4-diene-1-carboxylate Openeye Name: 5-fluoro-4-hexanoyloxy-1-(1-propylbutyl)cyclohexa-2,4-diene-1-carboxylate CAS Name: 5-fluoro-1-heptan-4-yl-4-(1-oxohexoxy)-1-cyclohexa-2,4-dienecarboxylate IUPAC Name: 5-fluoro-1-heptan-4-yl-4-hexanoyloxycyclohexa-2,4-diene-1-carboxylate Traditional Name: 4-caproyloxy-5-fluoro-1-(1-propylbutyl)cyclohexa-2,4-diene-1-carboxylate Formula: C20H30FO4- MolecularWeight: 353.448203

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=C(CC(C=C1)(C(CCC)CCC)C(=O)[O-])F

Isomeric SMILES

CCCCCC(=O)OC1=C(CC(C=C1)(C(CCC)CCC)C(=O)[O-])F

InChI

InChI=1S/C20H31FO4/c1-4-7-8-11-18(22)25-17-12-13-20(19(23)24,14-16(17)21)15(9-5-2)10-6-3/h12-13,15H,4-11,14H2,1-3H3,(H,23,24)/p-1