5-[(4-chloranyl-2-fluoranyl-5-propan-2-yloxy-phenyl)amino]-5-oxidanylidene-3-(trifluoromethyl)pentanoic acid

Systemtic Name: 5-[(4-chloranyl-2-fluoranyl-5-propan-2-yloxy-phenyl)amino]-5-oxidanylidene-3-(trifluoromethyl)pentanoic acid Openeye Name: 5-(4-chloro-2-fluoro-5-isopropoxy-anilino)-5-oxo-3-(trifluoromethyl)pentanoic acid CAS Name: 5-(4-chloro-2-fluoro-5-propan-2-yloxyanilino)-5-oxo-3-(trifluoromethyl)pentanoic acid IUPAC Name: 5-(4-chloro-2-fluoro-5-propan-2-yloxyanilino)-5-oxo-3-(trifluoromethyl)pentanoic acid Traditional Name: 5-(4-chloro-2-fluoro-5-isopropoxy-anilino)-5-keto-3-(trifluoromethyl)valeric acid Formula: C15H16ClF4NO4 MolecularWeight: 385.738453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C(=C1)NC(=O)CC(CC(=O)O)C(F)(F)F)F)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C(=C1)NC(=O)CC(CC(=O)O)C(F)(F)F)F)Cl

InChI

InChI=1S/C15H16ClF4NO4/c1-7(2)25-12-6-11(10(17)5-9(12)16)21-13(22)3-8(4-14(23)24)15(18,19)20/h5-8H,3-4H2,1-2H3,(H,21,22)(H,23,24)