[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-2-fluoranyl-benzoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-2-fluoranyl-benzoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 4-chloro-2-fluoro-benzoate CAS Name: 4-chloro-2-fluorobenzoic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 4-chloro-2-fluorobenzoate Traditional Name: 4-chloro-2-fluoro-benzoic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C15H14ClFN2O3 MolecularWeight: 324.734663

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)COC(=O)C2=C(C=C(C=C2)Cl)F

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)COC(=O)C2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C15H14ClFN2O3/c16-10-3-4-11(12(17)7-10)14(21)22-8-13(20)19-15(9-18)5-1-2-6-15/h3-4,7H,1-2,5-6,8H2,(H,19,20)