1-decoxy-2-fluoranyl-4-phenyl-cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: 1-decoxy-2-fluoranyl-4-phenyl-cyclohexa-2,5-diene-1-carboxylate Openeye Name: 1-decoxy-2-fluoro-4-phenyl-cyclohexa-2,5-diene-1-carboxylate CAS Name: 1-decoxy-2-fluoro-4-phenyl-1-cyclohexa-2,5-dienecarboxylate IUPAC Name: 1-decoxy-2-fluoro-4-phenylcyclohexa-2,5-diene-1-carboxylate Traditional Name: 1-decoxy-2-fluoro-4-phenyl-cyclohexa-2,5-diene-1-carboxylate Formula: C23H30FO3- MolecularWeight: 373.480903

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1(C=CC(C=C1F)C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CCCCCCCCCCOC1(C=CC(C=C1F)C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C23H31FO3/c1-2-3-4-5-6-7-8-12-17-27-23(22(25)26)16-15-20(18-21(23)24)19-13-10-9-11-14-19/h9-11,13-16,18,20H,2-8,12,17H2,1H3,(H,25,26)/p-1