methyl 6-bromanyl-4-(1-methoxy-2-methyl-1-oxidanylidene-propan-2-yl)-2-oxidanylidene-3,4-dihydrochromene-3-carboxylate

Systemtic Name: methyl 6-bromanyl-4-(1-methoxy-2-methyl-1-oxidanylidene-propan-2-yl)-2-oxidanylidene-3,4-dihydrochromene-3-carboxylate Openeye Name: methyl 6-bromo-4-(2-methoxy-1,1-dimethyl-2-oxo-ethyl)-2-oxo-chromane-3-carboxylate CAS Name: 6-bromo-4-(1-methoxy-2-methyl-1-oxopropan-2-yl)-2-oxo-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-bromo-4-(1-methoxy-2-methyl-1-oxopropan-2-yl)-2-oxo-3,4-dihydrochromene-3-carboxylate Traditional Name: 6-bromo-2-keto-4-(2-keto-2-methoxy-1,1-dimethyl-ethyl)chroman-3-carboxylic acid methyl ester Formula: C16H17BrO6 MolecularWeight: 385.20658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C(C(=O)OC2=C1C=C(C=C2)Br)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)(C1C(C(=O)OC2=C1C=C(C=C2)Br)C(=O)OC)C(=O)OC

InChI

InChI=1S/C16H17BrO6/c1-16(2,15(20)22-4)12-9-7-8(17)5-6-10(9)23-14(19)11(12)13(18)21-3/h5-7,11-12H,1-4H3