4-(2-ethyl-2-methoxycarbonyl-4-methyl-5-oxidanyl-5-oxidanylidene-pentoxy)carbonyl-4-(hydroxymethyl)-2-methyl-hexanoic acid

Systemtic Name: 4-(2-ethyl-2-methoxycarbonyl-4-methyl-5-oxidanyl-5-oxidanylidene-pentoxy)carbonyl-4-(hydroxymethyl)-2-methyl-hexanoic acid Openeye Name: 4-(2-ethyl-5-hydroxy-2-methoxycarbonyl-4-methyl-5-oxo-pentoxy)carbonyl-4-(hydroxymethyl)-2-methyl-hexanoic acid CAS Name: 4-[(2-ethyl-5-hydroxy-2-methoxycarbonyl-4-methyl-5-oxopentoxy)-oxomethyl]-4-(hydroxymethyl)-2-methylhexanoic acid IUPAC Name: 4-(2-ethyl-5-hydroxy-2-methoxycarbonyl-4-methyl-5-oxopentoxy)carbonyl-4-(hydroxymethyl)-2-methylhexanoic acid Traditional Name: 4-(2-carbomethoxy-2-ethyl-5-hydroxy-5-keto-4-methyl-pentoxy)carbonyl-2-methyl-4-methylol-hexanoic acid Formula: C19H32O9 MolecularWeight: 404.45198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C(=O)O)(CO)C(=O)OCC(CC)(CC(C)C(=O)O)C(=O)OC

Isomeric SMILES

CCC(CC(C)C(=O)O)(CO)C(=O)OCC(CC)(CC(C)C(=O)O)C(=O)OC

InChI

InChI=1S/C19H32O9/c1-6-18(10-20,8-12(3)14(21)22)17(26)28-11-19(7-2,16(25)27-5)9-13(4)15(23)24/h12-13,20H,6-11H2,1-5H3,(H,21,22)(H,23,24)