9-(2,2-dimethylpropyl)-9-(8-oxidanyl-8-oxidanylidene-octyl)heptadecanedioic acid

Systemtic Name: 9-(2,2-dimethylpropyl)-9-(8-oxidanyl-8-oxidanylidene-octyl)heptadecanedioic acid Openeye Name: 9-(2,2-dimethylpropyl)-9-(8-hydroxy-8-oxo-octyl)heptadecanedioic acid CAS Name: 9-(2,2-dimethylpropyl)-9-(8-hydroxy-8-oxooctyl)heptadecanedioic acid IUPAC Name: 9-(2,2-dimethylpropyl)-9-(8-hydroxy-8-oxooctyl)heptadecanedioic acid Traditional Name: 9-(8-hydroxy-8-keto-octyl)-9-neopentyl-heptadecanedioic acid Formula: C30H56O6 MolecularWeight: 512.76204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(CCCCCCCC(=O)O)(CCCCCCCC(=O)O)CCCCCCCC(=O)O

Isomeric SMILES

CC(C)(C)CC(CCCCCCCC(=O)O)(CCCCCCCC(=O)O)CCCCCCCC(=O)O

InChI

InChI=1S/C30H56O6/c1-29(2,3)25-30(22-16-10-4-7-13-19-26(31)32,23-17-11-5-8-14-20-27(33)34)24-18-12-6-9-15-21-28(35)36/h4-25H2,1-3H3,(H,31,32)(H,33,34)(H,35,36)