O1-ethyl O2-methyl 6-(4-bromophenyl)carbonyl-4-hexyl-3-oxidanyl-benzene-1,2-dicarboxylate

Systemtic Name: O1-ethyl O2-methyl 6-(4-bromophenyl)carbonyl-4-hexyl-3-oxidanyl-benzene-1,2-dicarboxylate Openeye Name: O1-ethyl O2-methyl 6-(4-bromobenzoyl)-4-hexyl-3-hydroxy-benzene-1,2-dicarboxylate CAS Name: 6-[(4-bromophenyl)-oxomethyl]-4-hexyl-3-hydroxybenzene-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester IUPAC Name: 1-O-ethyl 2-O-methyl 6-(4-bromobenzoyl)-4-hexyl-3-hydroxybenzene-1,2-dicarboxylate Traditional Name: 6-(4-bromobenzoyl)-4-hexyl-3-hydroxy-benzene-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester Formula: C24H27BrO6 MolecularWeight: 491.37158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)C(=O)OCC)C(=O)OC)O

Isomeric SMILES

CCCCCCC1=C(C(=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)C(=O)OCC)C(=O)OC)O

InChI

InChI=1S/C24H27BrO6/c1-4-6-7-8-9-16-14-18(21(26)15-10-12-17(25)13-11-15)19(24(29)31-5-2)20(22(16)27)23(28)30-3/h10-14,27H,4-9H2,1-3H3