(4-bromanyl-2,6-dimethyl-phenyl) 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: (4-bromanyl-2,6-dimethyl-phenyl) 2-oxidanylidenechromene-3-carboxylate Openeye Name: (4-bromo-2,6-dimethyl-phenyl) 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid (4-bromo-2,6-dimethylphenyl) ester IUPAC Name: (4-bromo-2,6-dimethylphenyl) 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid (4-bromo-2,6-dimethyl-phenyl) ester Formula: C18H13BrO4 MolecularWeight: 373.19742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=CC3=CC=CC=C3OC2=O)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=CC3=CC=CC=C3OC2=O)C)Br

InChI

InChI=1S/C18H13BrO4/c1-10-7-13(19)8-11(2)16(10)23-18(21)14-9-12-5-3-4-6-15(12)22-17(14)20/h3-9H,1-2H3