[2-[2-cyanoethyl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-2-fluoranyl-benzoate

Systemtic Name: [2-[2-cyanoethyl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] 4-chloranyl-2-fluoranyl-benzoate Openeye Name: [2-[2-cyanoethyl(2-furylmethyl)amino]-2-oxo-ethyl] 4-chloro-2-fluoro-benzoate CAS Name: 4-chloro-2-fluorobenzoic acid [2-[2-cyanoethyl(2-furanylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanoethyl(furan-2-ylmethyl)amino]-2-oxoethyl] 4-chloro-2-fluorobenzoate Traditional Name: 4-chloro-2-fluoro-benzoic acid [2-[2-cyanoethyl(2-furfuryl)amino]-2-keto-ethyl] ester Formula: C17H14ClFN2O4 MolecularWeight: 364.755463

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN(CCC#N)C(=O)COC(=O)C2=C(C=C(C=C2)Cl)F

Isomeric SMILES

C1=COC(=C1)CN(CCC#N)C(=O)COC(=O)C2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C17H14ClFN2O4/c18-12-4-5-14(15(19)9-12)17(23)25-11-16(22)21(7-2-6-20)10-13-3-1-8-24-13/h1,3-5,8-9H,2,7,10-11H2