[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 4-chloranyl-2-[(4-fluorophenyl)carbonylamino]benzoate

Systemtic Name: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 4-chloranyl-2-[(4-fluorophenyl)carbonylamino]benzoate Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] 4-chloro-2-[(4-fluorobenzoyl)amino]benzoate CAS Name: 4-chloro-2-[[(4-fluorophenyl)-oxomethyl]amino]benzoic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 4-chloro-2-[(4-fluorobenzoyl)amino]benzoate Traditional Name: 4-chloro-2-[(4-fluorobenzoyl)amino]benzoic acid [2-(tert-amylamino)-2-keto-ethyl] ester Formula: C21H22ClFN2O4 MolecularWeight: 420.861783

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCC(C)(C)NC(=O)COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C21H22ClFN2O4/c1-4-21(2,3)25-18(26)12-29-20(28)16-10-7-14(22)11-17(16)24-19(27)13-5-8-15(23)9-6-13/h5-11H,4,12H2,1-3H3,(H,24,27)(H,25,26)