5-[3,5-bis(trifluoromethyl)phenoxy]-2-(cyclopropylcarbonylamino)benzoic acid

Systemtic Name: 5-[3,5-bis(trifluoromethyl)phenoxy]-2-(cyclopropylcarbonylamino)benzoic acid Openeye Name: 5-[3,5-bis(trifluoromethyl)phenoxy]-2-(cyclopropanecarbonylamino)benzoic acid CAS Name: 5-[3,5-bis(trifluoromethyl)phenoxy]-2-[[cyclopropyl(oxo)methyl]amino]benzoic acid IUPAC Name: 5-[3,5-bis(trifluoromethyl)phenoxy]-2-(cyclopropanecarbonylamino)benzoic acid Traditional Name: 5-[3,5-bis(trifluoromethyl)phenoxy]-2-(cyclopropanecarbonylamino)benzoic acid Formula: C19H13F6NO4 MolecularWeight: 433.301239

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=C(C=C(C=C2)OC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)O

Isomeric SMILES

C1CC1C(=O)NC2=C(C=C(C=C2)OC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C(=O)O

InChI

InChI=1S/C19H13F6NO4/c20-18(21,22)10-5-11(19(23,24)25)7-13(6-10)30-12-3-4-15(14(8-12)17(28)29)26-16(27)9-1-2-9/h3-9H,1-2H2,(H,26,27)(H,28,29)