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

Systemtic Name: 4-(6-decoxynaphthalen-2-yl)-2,3-bis(fluoranyl)benzoic acid Openeye Name: 4-(6-decoxy-2-naphthyl)-2,3-difluoro-benzoic acid CAS Name: 4-(6-decoxy-2-naphthalenyl)-2,3-difluorobenzoic acid IUPAC Name: 4-(6-decoxynaphthalen-2-yl)-2,3-difluorobenzoic acid Traditional Name: 4-(6-decoxy-2-naphthyl)-2,3-difluoro-benzoic acid Formula: C27H30F2O3 MolecularWeight: 440.522106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)C3=C(C(=C(C=C3)C(=O)O)F)F

Isomeric SMILES

CCCCCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)C3=C(C(=C(C=C3)C(=O)O)F)F

InChI

InChI=1S/C27H30F2O3/c1-2-3-4-5-6-7-8-9-16-32-22-13-12-19-17-21(11-10-20(19)18-22)23-14-15-24(27(30)31)26(29)25(23)28/h10-15,17-18H,2-9,16H2,1H3,(H,30,31)