4-(6-decylnaphthalen-2-yl)-2,3-bis(fluoranyl)benzoic acid

Systemtic Name: 4-(6-decylnaphthalen-2-yl)-2,3-bis(fluoranyl)benzoic acid Openeye Name: 4-(6-decyl-2-naphthyl)-2,3-difluoro-benzoic acid CAS Name: 4-(6-decyl-2-naphthalenyl)-2,3-difluorobenzoic acid IUPAC Name: 4-(6-decylnaphthalen-2-yl)-2,3-difluorobenzoic acid Traditional Name: 4-(6-decyl-2-naphthyl)-2,3-difluoro-benzoic acid Formula: C27H30F2O2 MolecularWeight: 424.522706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC2=C(C=C1)C=C(C=C2)C3=C(C(=C(C=C3)C(=O)O)F)F

Isomeric SMILES

CCCCCCCCCCC1=CC2=C(C=C1)C=C(C=C2)C3=C(C(=C(C=C3)C(=O)O)F)F

InChI

InChI=1S/C27H30F2O2/c1-2-3-4-5-6-7-8-9-10-19-11-12-21-18-22(14-13-20(21)17-19)23-15-16-24(27(30)31)26(29)25(23)28/h11-18H,2-10H2,1H3,(H,30,31)