3-[[3-[4-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbonylamino]phenyl]-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylic acid

Systemtic Name: 3-[[3-[4-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbonylamino]phenyl]-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylic acid Openeye Name: 3-[[1-[[4-[[2-chloro-5-(trifluoromethyl)benzoyl]amino]phenyl]methyl]-2-methoxy-2-oxo-ethyl]carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid CAS Name: 3-[[[3-[4-[[[2-chloro-5-(trifluoromethyl)phenyl]-oxomethyl]amino]phenyl]-1-methoxy-1-oxopropan-2-yl]amino]-oxomethyl]-1,2,2-trimethyl-1-cyclopentanecarboxylic acid IUPAC Name: 3-[[3-[4-[[2-chloro-5-(trifluoromethyl)benzoyl]amino]phenyl]-1-methoxy-1-oxopropan-2-yl]carbamoyl]-1,2,2-trimethylcyclopentane-1-carboxylic acid Traditional Name: 3-[[1-[4-[[2-chloro-5-(trifluoromethyl)benzoyl]amino]benzyl]-2-keto-2-methoxy-ethyl]carbamoyl]-1,2,2-trimethyl-cyclopentanecarboxylic acid Formula: C28H30ClF3N2O6 MolecularWeight: 582.99581

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1(C)C(=O)O)C(=O)NC(CC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)C(=O)OC)C

Isomeric SMILES

CC1(C(CCC1(C)C(=O)O)C(=O)NC(CC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)C(=O)OC)C

InChI

InChI=1S/C28H30ClF3N2O6/c1-26(2)19(11-12-27(26,3)25(38)39)23(36)34-21(24(37)40-4)13-15-5-8-17(9-6-15)33-22(35)18-14-16(28(30,31)32)7-10-20(18)29/h5-10,14,19,21H,11-13H2,1-4H3,(H,33,35)(H,34,36)(H,38,39)