3-(2-methoxycarbonyl-2-methyl-butyl)-5-methyl-7-(oxan-2-yloxy)-7-oxidanylidene-heptanoic acid

Systemtic Name: 3-(2-methoxycarbonyl-2-methyl-butyl)-5-methyl-7-(oxan-2-yloxy)-7-oxidanylidene-heptanoic acid Openeye Name: 3-(2-methoxycarbonyl-2-methyl-butyl)-5-methyl-7-oxo-7-tetrahydropyran-2-yloxy-heptanoic acid CAS Name: 3-(2-methoxycarbonyl-2-methylbutyl)-5-methyl-7-(2-oxanyloxy)-7-oxoheptanoic acid IUPAC Name: 3-(2-methoxycarbonyl-2-methylbutyl)-5-methyl-7-(oxan-2-yloxy)-7-oxoheptanoic acid Traditional Name: 3-(2-carbomethoxy-2-methyl-butyl)-7-keto-5-methyl-7-tetrahydropyran-2-yloxy-enanthic acid Formula: C20H34O7 MolecularWeight: 386.47976

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(CC(C)CC(=O)OC1CCCCO1)CC(=O)O)C(=O)OC

Isomeric SMILES

CCC(C)(CC(CC(C)CC(=O)OC1CCCCO1)CC(=O)O)C(=O)OC

InChI

InChI=1S/C20H34O7/c1-5-20(3,19(24)25-4)13-15(12-16(21)22)10-14(2)11-17(23)27-18-8-6-7-9-26-18/h14-15,18H,5-13H2,1-4H3,(H,21,22)