3,6-bis(trifluoromethyl)phenanthrene-9-carboxylic acid

Systemtic Name: 3,6-bis(trifluoromethyl)phenanthrene-9-carboxylic acid Openeye Name: 3,6-bis(trifluoromethyl)phenanthrene-9-carboxylic acid CAS Name: 3,6-bis(trifluoromethyl)-9-phenanthrenecarboxylic acid IUPAC Name: 3,6-bis(trifluoromethyl)phenanthrene-9-carboxylic acid Traditional Name: 3,6-bis(trifluoromethyl)phenanthrene-9-carboxylic acid Formula: C17H8F6O2 MolecularWeight: 358.234639

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C3C=C(C=CC3=C(C=C21)C(=O)O)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC(=CC2=C3C=C(C=CC3=C(C=C21)C(=O)O)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H8F6O2/c18-16(19,20)9-2-1-8-5-14(15(24)25)11-4-3-10(17(21,22)23)7-13(11)12(8)6-9/h1-7H,(H,24,25)