6-bromanyl-3-methoxy-1-oxidanylidene-isochromene-4-carboxylic acid

Systemtic Name: 6-bromanyl-3-methoxy-1-oxidanylidene-isochromene-4-carboxylic acid Openeye Name: 6-bromo-3-methoxy-1-oxo-isochromene-4-carboxylic acid CAS Name: 6-bromo-3-methoxy-1-oxo-2-benzopyran-4-carboxylic acid IUPAC Name: 6-bromo-3-methoxy-1-oxoisochromene-4-carboxylic acid Traditional Name: 6-bromo-1-keto-3-methoxy-isochromene-4-carboxylic acid Formula: C11H7BrO5 MolecularWeight: 299.07428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=CC(=C2)Br)C(=O)O1)C(=O)O

Isomeric SMILES

COC1=C(C2=C(C=CC(=C2)Br)C(=O)O1)C(=O)O

InChI

InChI=1S/C11H7BrO5/c1-16-11-8(9(13)14)7-4-5(12)2-3-6(7)10(15)17-11/h2-4H,1H3,(H,13,14)