8-bromanyl-3-imidazol-1-yl-4-oxidanylidene-2,3-dihydrochromene-6-carboxylic acid

Systemtic Name: 8-bromanyl-3-imidazol-1-yl-4-oxidanylidene-2,3-dihydrochromene-6-carboxylic acid Openeye Name: 8-bromo-3-imidazol-1-yl-4-oxo-chromane-6-carboxylic acid CAS Name: 8-bromo-3-(1-imidazolyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid IUPAC Name: 8-bromo-3-imidazol-1-yl-4-oxo-2,3-dihydrochromene-6-carboxylic acid Traditional Name: 8-bromo-3-imidazol-1-yl-4-keto-chroman-6-carboxylic acid Formula: C13H9BrN2O4 MolecularWeight: 337.12556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2=CC(=CC(=C2O1)Br)C(=O)O)N3C=CN=C3

Isomeric SMILES

C1C(C(=O)C2=CC(=CC(=C2O1)Br)C(=O)O)N3C=CN=C3

InChI

InChI=1S/C13H9BrN2O4/c14-9-4-7(13(18)19)3-8-11(17)10(5-20-12(8)9)16-2-1-15-6-16/h1-4,6,10H,5H2,(H,18,19)