1-azanyl-3-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-3-phenyl-cyclobutane-1-carboxylic acid

Systemtic Name: 1-azanyl-3-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-3-phenyl-cyclobutane-1-carboxylic acid Openeye Name: 1-amino-3-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-3-phenyl-cyclobutanecarboxylic acid CAS Name: 1-amino-3-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-3-phenyl-1-cyclobutanecarboxylic acid IUPAC Name: 1-amino-3-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-3-phenylcyclobutane-1-carboxylic acid Traditional Name: 1-amino-3-[[3,5-bis(trifluoromethyl)benzyl]oxymethyl]-3-phenyl-cyclobutanecarboxylic acid Formula: C21H19F6NO3 MolecularWeight: 447.370879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CC1(C(=O)O)N)(COCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

C1C(CC1(C(=O)O)N)(COCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C21H19F6NO3/c22-20(23,24)15-6-13(7-16(8-15)21(25,26)27)9-31-12-18(14-4-2-1-3-5-14)10-19(28,11-18)17(29)30/h1-8H,9-12,28H2,(H,29,30)