2,6-bis(fluoranyl)-4-(4-pentylcyclohexa-1,3-dien-1-yl)benzoic acid

Systemtic Name: 2,6-bis(fluoranyl)-4-(4-pentylcyclohexa-1,3-dien-1-yl)benzoic acid Openeye Name: 2,6-difluoro-4-(4-pentylcyclohexa-1,3-dien-1-yl)benzoic acid CAS Name: 2,6-difluoro-4-(4-pentyl-1-cyclohexa-1,3-dienyl)benzoic acid IUPAC Name: 2,6-difluoro-4-(4-pentylcyclohexa-1,3-dien-1-yl)benzoic acid Traditional Name: 4-(4-amylcyclohexa-1,3-dien-1-yl)-2,6-difluoro-benzoic acid Formula: C18H20F2O2 MolecularWeight: 306.347006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(CC1)C2=CC(=C(C(=C2)F)C(=O)O)F

Isomeric SMILES

CCCCCC1=CC=C(CC1)C2=CC(=C(C(=C2)F)C(=O)O)F

InChI

InChI=1S/C18H20F2O2/c1-2-3-4-5-12-6-8-13(9-7-12)14-10-15(19)17(18(21)22)16(20)11-14/h6,8,10-11H,2-5,7,9H2,1H3,(H,21,22)