diethyl 6-(4-bromophenyl)carbonyl-4-ethyl-3-oxidanyl-benzene-1,2-dicarboxylate

Systemtic Name: diethyl 6-(4-bromophenyl)carbonyl-4-ethyl-3-oxidanyl-benzene-1,2-dicarboxylate Openeye Name: diethyl 6-(4-bromobenzoyl)-4-ethyl-3-hydroxy-benzene-1,2-dicarboxylate CAS Name: 6-[(4-bromophenyl)-oxomethyl]-4-ethyl-3-hydroxybenzene-1,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 6-(4-bromobenzoyl)-4-ethyl-3-hydroxybenzene-1,2-dicarboxylate Traditional Name: 6-(4-bromobenzoyl)-4-ethyl-3-hydroxy-benzene-1,2-dicarboxylic acid diethyl ester Formula: C21H21BrO6 MolecularWeight: 449.29184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)C(=O)OCC)C(=O)OCC)O

Isomeric SMILES

CCC1=C(C(=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)C(=O)OCC)C(=O)OCC)O

InChI

InChI=1S/C21H21BrO6/c1-4-12-11-15(18(23)13-7-9-14(22)10-8-13)16(20(25)27-5-2)17(19(12)24)21(26)28-6-3/h7-11,24H,4-6H2,1-3H3