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

Systemtic Name: O1-ethyl O2-methyl 4-hexyl-6-(4-methylphenyl)carbonyl-3-oxidanyl-benzene-1,2-dicarboxylate Openeye Name: O1-ethyl O2-methyl 4-hexyl-3-hydroxy-6-(4-methylbenzoyl)benzene-1,2-dicarboxylate CAS Name: 4-hexyl-3-hydroxy-6-[(4-methylphenyl)-oxomethyl]benzene-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester IUPAC Name: 1-O-ethyl 2-O-methyl 4-hexyl-3-hydroxy-6-(4-methylbenzoyl)benzene-1,2-dicarboxylate Traditional Name: 4-hexyl-3-hydroxy-6-p-toluoyl-benzene-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30O6/c1-5-7-8-9-10-18-15-19(22(26)17-13-11-16(3)12-14-17)20(25(29)31-6-2)21(23(18)27)24(28)30-4/h11-15,27H,5-10H2,1-4H3