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

Systemtic Name: O1-ethyl O2-methyl 4-hexyl-3-oxidanyl-6-(phenylcarbonyl)benzene-1,2-dicarboxylate Openeye Name: O1-ethyl O2-methyl 6-benzoyl-4-hexyl-3-hydroxy-benzene-1,2-dicarboxylate CAS Name: 6-benzoyl-4-hexyl-3-hydroxybenzene-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester IUPAC Name: 1-O-ethyl 2-O-methyl 6-benzoyl-4-hexyl-3-hydroxybenzene-1,2-dicarboxylate Traditional Name: 6-benzoyl-4-hexyl-3-hydroxy-benzene-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester Formula: C24H28O6 MolecularWeight: 412.47552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28O6/c1-4-6-7-9-14-17-15-18(21(25)16-12-10-8-11-13-16)19(24(28)30-5-2)20(22(17)26)23(27)29-3/h8,10-13,15,26H,4-7,9,14H2,1-3H3