tert-butyl 5-bromanyl-3-oxidanylidene-4H-chromene-4-carboxylate

Systemtic Name: tert-butyl 5-bromanyl-3-oxidanylidene-4H-chromene-4-carboxylate Openeye Name: tert-butyl 5-bromo-3-oxo-chromane-4-carboxylate CAS Name: 5-bromo-3-oxo-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-bromo-3-oxo-4H-chromene-4-carboxylate Traditional Name: 5-bromo-3-keto-chroman-4-carboxylic acid tert-butyl ester Formula: C14H15BrO4 MolecularWeight: 327.1705

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(=O)COC2=C1C(=CC=C2)Br

Isomeric SMILES

CC(C)(C)OC(=O)C1C(=O)COC2=C1C(=CC=C2)Br

InChI

InChI=1S/C14H15BrO4/c1-14(2,3)19-13(17)12-9(16)7-18-10-6-4-5-8(15)11(10)12/h4-6,12H,7H2,1-3H3