2-(4-fluorophenyl)adamantane-2-carboxylic acid

Systemtic Name: 2-(4-fluorophenyl)adamantane-2-carboxylic acid Openeye Name: 2-(4-fluorophenyl)adamantane-2-carboxylic acid CAS Name: 2-(4-fluorophenyl)-2-adamantanecarboxylic acid IUPAC Name: 2-(4-fluorophenyl)adamantane-2-carboxylic acid Traditional Name: 2-(4-fluorophenyl)adamantane-2-carboxylic acid Formula: C17H19FO2 MolecularWeight: 274.329963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3(C4=CC=C(C=C4)F)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)C3(C4=CC=C(C=C4)F)C(=O)O

InChI

InChI=1S/C17H19FO2/c18-15-3-1-12(2-4-15)17(16(19)20)13-6-10-5-11(8-13)9-14(17)7-10/h1-4,10-11,13-14H,5-9H2,(H,19,20)