2-[1-methanoyl-9-(trifluoromethyl)phenanthren-2-yl]pyridine-3-carboxylic acid

Systemtic Name: 2-[1-methanoyl-9-(trifluoromethyl)phenanthren-2-yl]pyridine-3-carboxylic acid Openeye Name: 2-[1-formyl-9-(trifluoromethyl)-2-phenanthryl]pyridine-3-carboxylic acid CAS Name: 2-[1-formyl-9-(trifluoromethyl)-2-phenanthrenyl]-3-pyridinecarboxylic acid IUPAC Name: 2-[1-formyl-9-(trifluoromethyl)phenanthren-2-yl]pyridine-3-carboxylic acid Traditional Name: 2-[1-formyl-9-(trifluoromethyl)-2-phenanthryl]nicotinic acid Formula: C22H12F3NO3 MolecularWeight: 395.33079

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=C2C(F)(F)F)C(=C(C=C3)C4=C(C=CC=N4)C(=O)O)C=O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=C2C(F)(F)F)C(=C(C=C3)C4=C(C=CC=N4)C(=O)O)C=O

InChI

InChI=1S/C22H12F3NO3/c23-22(24,25)19-10-17-13(12-4-1-2-5-14(12)19)7-8-15(18(17)11-27)20-16(21(28)29)6-3-9-26-20/h1-11H,(H,28,29)