[2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 5-bromanyl-2-fluoranyl-benzoate

Systemtic Name: [2-[(2-cyanophenyl)amino]-2-oxidanylidene-ethyl] 5-bromanyl-2-fluoranyl-benzoate Openeye Name: [2-(2-cyanoanilino)-2-oxo-ethyl] 5-bromo-2-fluoro-benzoate CAS Name: 5-bromo-2-fluorobenzoic acid [2-(2-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoanilino)-2-oxoethyl] 5-bromo-2-fluorobenzoate Traditional Name: 5-bromo-2-fluoro-benzoic acid [2-(2-cyanoanilino)-2-keto-ethyl] ester Formula: C16H10BrFN2O3 MolecularWeight: 377.164603

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10BrFN2O3/c17-11-5-6-13(18)12(7-11)16(22)23-9-15(21)20-14-4-2-1-3-10(14)8-19/h1-7H,9H2,(H,20,21)