(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 5-bromanyl-2-fluoranyl-benzoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 5-bromanyl-2-fluoranyl-benzoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 5-bromo-2-fluoro-benzoate CAS Name: 5-bromo-2-fluorobenzoic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 5-bromo-2-fluorobenzoate Traditional Name: 5-bromo-2-fluoro-benzoic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C19H13BrFNO5 MolecularWeight: 434.212623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C=CC(=C3)Br)F

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C19H13BrFNO5/c1-10(23)22-13-3-4-14-11(6-18(24)27-17(14)8-13)9-26-19(25)15-7-12(20)2-5-16(15)21/h2-8H,9H2,1H3,(H,22,23)