methyl 1-bromanyl-2-methoxy-3,4,5-tris(oxidanyl)-6-oxidanylidene-benzo[7]annulene-8-carboxylate

Systemtic Name: methyl 1-bromanyl-2-methoxy-3,4,5-tris(oxidanyl)-6-oxidanylidene-benzo[7]annulene-8-carboxylate Openeye Name: methyl 1-bromo-3,4,5-trihydroxy-2-methoxy-6-oxo-benzo[7]annulene-8-carboxylate CAS Name: 1-bromo-3,4,5-trihydroxy-2-methoxy-6-oxo-8-benzo[7]annulenecarboxylic acid methyl ester IUPAC Name: methyl 1-bromo-3,4,5-trihydroxy-2-methoxy-6-oxobenzo[7]annulene-8-carboxylate Traditional Name: 1-bromo-3,4,5-trihydroxy-6-keto-2-methoxy-benzocycloheptene-8-carboxylic acid methyl ester Formula: C14H11BrO7 MolecularWeight: 371.13694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC(=CC(=O)C(=C2C(=C1O)O)O)C(=O)OC)Br

Isomeric SMILES

COC1=C(C2=CC(=CC(=O)C(=C2C(=C1O)O)O)C(=O)OC)Br

InChI

InChI=1S/C14H11BrO7/c1-21-13-9(15)6-3-5(14(20)22-2)4-7(16)10(17)8(6)11(18)12(13)19/h3-4,18-19H,1-2H3,(H,16,17)