[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-(2-bromanyl-4-fluoranyl-phenoxy)ethanoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 2-(2-bromo-4-fluoro-phenoxy)acetate CAS Name: 2-(2-bromo-4-fluorophenoxy)acetic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-(2-bromo-4-fluorophenoxy)acetate Traditional Name: 2-(2-bromo-4-fluoro-phenoxy)acetic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C16H16BrFN2O4 MolecularWeight: 399.211643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)COC(=O)COC2=C(C=C(C=C2)F)Br

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)COC(=O)COC2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C16H16BrFN2O4/c17-12-7-11(18)3-4-13(12)23-9-15(22)24-8-14(21)20-16(10-19)5-1-2-6-16/h3-4,7H,1-2,5-6,8-9H2,(H,20,21)