[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-[(5-bromanylfuran-2-yl)carbonylamino]ethanoate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate CAS Name: 2-[[(5-bromo-2-furanyl)-oxomethyl]amino]acetic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate Traditional Name: 2-[(5-bromo-2-furoyl)amino]acetic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C17H15BrFNO5 MolecularWeight: 412.207103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCOC(=O)CNC(=O)C2=CC=C(O2)Br)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCOC(=O)CNC(=O)C2=CC=C(O2)Br)F

InChI

InChI=1S/C17H15BrFNO5/c18-15-8-7-14(25-15)17(23)20-10-16(22)24-9-1-2-13(21)11-3-5-12(19)6-4-11/h3-8H,1-2,9-10H2,(H,20,23)