2-fluoranyl-4-(4-pentylcyclohexa-1,3-dien-1-yl)benzoate

Systemtic Name: 2-fluoranyl-4-(4-pentylcyclohexa-1,3-dien-1-yl)benzoate Openeye Name: 2-fluoro-4-(4-pentylcyclohexa-1,3-dien-1-yl)benzoate CAS Name: 2-fluoro-4-(4-pentyl-1-cyclohexa-1,3-dienyl)benzoate IUPAC Name: 2-fluoro-4-(4-pentylcyclohexa-1,3-dien-1-yl)benzoate Traditional Name: 4-(4-amylcyclohexa-1,3-dien-1-yl)-2-fluoro-benzoate Formula: C18H20FO2- MolecularWeight: 287.348603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(CC1)C2=CC(=C(C=C2)C(=O)[O-])F

Isomeric SMILES

CCCCCC1=CC=C(CC1)C2=CC(=C(C=C2)C(=O)[O-])F

InChI

InChI=1S/C18H21FO2/c1-2-3-4-5-13-6-8-14(9-7-13)15-10-11-16(18(20)21)17(19)12-15/h6,8,10-12H,2-5,7,9H2,1H3,(H,20,21)/p-1