5-[(3-acetamido-4-methoxy-phenyl)amino]-5-oxidanylidene-3-(trifluoromethyl)pentanoic acid

Systemtic Name: 5-[(3-acetamido-4-methoxy-phenyl)amino]-5-oxidanylidene-3-(trifluoromethyl)pentanoic acid Openeye Name: 5-(3-acetamido-4-methoxy-anilino)-5-oxo-3-(trifluoromethyl)pentanoic acid CAS Name: 5-(3-acetamido-4-methoxyanilino)-5-oxo-3-(trifluoromethyl)pentanoic acid IUPAC Name: 5-(3-acetamido-4-methoxyanilino)-5-oxo-3-(trifluoromethyl)pentanoic acid Traditional Name: 5-(3-acetamido-4-methoxy-anilino)-5-keto-3-(trifluoromethyl)valeric acid Formula: C15H17F3N2O5 MolecularWeight: 362.30109

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)CC(CC(=O)O)C(F)(F)F)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)CC(CC(=O)O)C(F)(F)F)OC

InChI

InChI=1S/C15H17F3N2O5/c1-8(21)19-11-7-10(3-4-12(11)25-2)20-13(22)5-9(6-14(23)24)15(16,17)18/h3-4,7,9H,5-6H2,1-2H3,(H,19,21)(H,20,22)(H,23,24)