4-ethanoyl-2,8-dimethyl-6-(2-methylpropyl)-5-oxidanyl-nonane-3,4,5-tricarboxylate

Systemtic Name: 4-ethanoyl-2,8-dimethyl-6-(2-methylpropyl)-5-oxidanyl-nonane-3,4,5-tricarboxylate Openeye Name: 4-acetyl-5-hydroxy-6-isobutyl-2,8-dimethyl-nonane-3,4,5-tricarboxylate CAS Name: 4-acetyl-5-hydroxy-2,8-dimethyl-6-(2-methylpropyl)nonane-3,4,5-tricarboxylate IUPAC Name: 4-acetyl-5-hydroxy-2,8-dimethyl-6-(2-methylpropyl)nonane-3,4,5-tricarboxylate Traditional Name: 4-acetyl-5-hydroxy-6-isobutyl-2,8-dimethyl-nonane-3,4,5-tricarboxylate Formula: C20H31O8-3 MolecularWeight: 399.45534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(C)C)(C(=O)[O-])C(C(=O)[O-])(C(CC(C)C)(C(=O)C)C(=O)[O-])O

Isomeric SMILES

CC(C)CC(CC(C)C)(C(=O)[O-])C(C(=O)[O-])(C(CC(C)C)(C(=O)C)C(=O)[O-])O

InChI

InChI=1S/C20H34O8/c1-11(2)8-18(15(22)23,9-12(3)4)20(28,17(26)27)19(14(7)21,16(24)25)10-13(5)6/h11-13,28H,8-10H2,1-7H3,(H,22,23)(H,24,25)(H,26,27)/p-3