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

Systemtic Name: 5-[(4-chloranyl-2-fluoranyl-5-prop-2-ynoxy-phenyl)amino]-5-oxidanylidene-3-(trifluoromethyl)pentanoic acid Openeye Name: 5-(4-chloro-2-fluoro-5-prop-2-ynoxy-anilino)-5-oxo-3-(trifluoromethyl)pentanoic acid CAS Name: 5-(4-chloro-2-fluoro-5-prop-2-ynoxyanilino)-5-oxo-3-(trifluoromethyl)pentanoic acid IUPAC Name: 5-(4-chloro-2-fluoro-5-prop-2-ynoxyanilino)-5-oxo-3-(trifluoromethyl)pentanoic acid Traditional Name: 5-(4-chloro-2-fluoro-5-propargyloxy-anilino)-5-keto-3-(trifluoromethyl)valeric acid Formula: C15H12ClF4NO4 MolecularWeight: 381.706693

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=C(C(=C1)NC(=O)CC(CC(=O)O)C(F)(F)F)F)Cl

Isomeric SMILES

C#CCOC1=C(C=C(C(=C1)NC(=O)CC(CC(=O)O)C(F)(F)F)F)Cl

InChI

InChI=1S/C15H12ClF4NO4/c1-2-3-25-12-7-11(10(17)6-9(12)16)21-13(22)4-8(5-14(23)24)15(18,19)20/h1,6-8H,3-5H2,(H,21,22)(H,23,24)