5-hexan-2-yl-4-hexan-2-yloxy-6-methyl-2-oxidanylidene-decane-2,3,4-tricarboxylic acid

Systemtic Name: 5-hexan-2-yl-4-hexan-2-yloxy-6-methyl-2-oxidanylidene-decane-2,3,4-tricarboxylic acid Openeye Name: 6-methyl-4-(1-methylpentoxy)-5-(1-methylpentyl)-2-oxo-decane-2,3,4-tricarboxylic acid CAS Name: 5-hexan-2-yl-4-hexan-2-yloxy-6-methyl-2-oxodecane-2,3,4-tricarboxylic acid IUPAC Name: 5-hexan-2-yl-4-hexan-2-yloxy-6-methyl-2-oxodecane-2,3,4-tricarboxylic acid Traditional Name: 2-keto-6-methyl-4-(1-methylpentoxy)-5-(1-methylpentyl)decane-2,3,4-tricarboxylic acid Formula: C26H46O8 MolecularWeight: 486.63864

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(C(C)CCCC)(C(=O)O)C(C(C(=O)C)C(=O)O)(C(=O)O)OC(C)CCCC

Isomeric SMILES

CCCCC(C)C(C(C)CCCC)(C(=O)O)C(C(C(=O)C)C(=O)O)(C(=O)O)OC(C)CCCC

InChI

InChI=1S/C26H46O8/c1-8-11-14-17(4)25(23(30)31,18(5)15-12-9-2)26(24(32)33,21(20(7)27)22(28)29)34-19(6)16-13-10-3/h17-19,21H,8-16H2,1-7H3,(H,28,29)(H,30,31)(H,32,33)