methyl 2-[6-bromanyl-2-oxidanylidene-3-(phenylcarbonyl)-3,4-dihydrochromen-4-yl]-2-methyl-propanoate

Systemtic Name: methyl 2-[6-bromanyl-2-oxidanylidene-3-(phenylcarbonyl)-3,4-dihydrochromen-4-yl]-2-methyl-propanoate Openeye Name: methyl 2-(3-benzoyl-6-bromo-2-oxo-chroman-4-yl)-2-methyl-propanoate CAS Name: 2-(3-benzoyl-6-bromo-2-oxo-3,4-dihydro-2H-1-benzopyran-4-yl)-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-(3-benzoyl-6-bromo-2-oxo-3,4-dihydrochromen-4-yl)-2-methylpropanoate Traditional Name: 2-(3-benzoyl-6-bromo-2-keto-chroman-4-yl)-2-methyl-propionic acid methyl ester Formula: C21H19BrO5 MolecularWeight: 431.27656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C(C(=O)OC2=C1C=C(C=C2)Br)C(=O)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)(C1C(C(=O)OC2=C1C=C(C=C2)Br)C(=O)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H19BrO5/c1-21(2,20(25)26-3)17-14-11-13(22)9-10-15(14)27-19(24)16(17)18(23)12-7-5-4-6-8-12/h4-11,16-17H,1-3H3