[2-[[3,4-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 5-bromanylfuran-2-carboxylate

Systemtic Name: [2-[[3,4-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 5-bromanylfuran-2-carboxylate Openeye Name: [2-(3,4-difluoroanilino)-2-oxo-ethyl] 5-bromofuran-2-carboxylate CAS Name: 5-bromo-2-furancarboxylic acid [2-(3,4-difluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-difluoroanilino)-2-oxoethyl] 5-bromofuran-2-carboxylate Traditional Name: 5-bromofuran-2-carboxylic acid [2-(3,4-difluoroanilino)-2-keto-ethyl] ester Formula: C13H8BrF2NO4 MolecularWeight: 360.107726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)COC(=O)C2=CC=C(O2)Br)F)F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)COC(=O)C2=CC=C(O2)Br)F)F

InChI

InChI=1S/C13H8BrF2NO4/c14-11-4-3-10(21-11)13(19)20-6-12(18)17-7-1-2-8(15)9(16)5-7/h1-5H,6H2,(H,17,18)