4-(7-heptan-2-yl-6-methyl-heptadecan-7-yl)oxy-3-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(7-heptan-2-yl-6-methyl-heptadecan-7-yl)oxy-3-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: 4-[1,1-bis(1-methylhexyl)undecoxy]-3-hydroxy-4-oxo-butanoic acid CAS Name: 4-(7-heptan-2-yl-6-methylheptadecan-7-yl)oxy-3-hydroxy-4-oxobutanoic acid IUPAC Name: 4-(7-heptan-2-yl-6-methylheptadecan-7-yl)oxy-3-hydroxy-4-oxobutanoic acid Traditional Name: 4-[1,1-bis(1-methylhexyl)undecoxy]-3-hydroxy-4-keto-butyric acid Formula: C29H56O5 MolecularWeight: 484.75194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(C)CCCCC)(C(C)CCCCC)OC(=O)C(CC(=O)O)O

Isomeric SMILES

CCCCCCCCCCC(C(C)CCCCC)(C(C)CCCCC)OC(=O)C(CC(=O)O)O

InChI

InChI=1S/C29H56O5/c1-6-9-12-13-14-15-16-19-22-29(24(4)20-17-10-7-2,25(5)21-18-11-8-3)34-28(33)26(30)23-27(31)32/h24-26,30H,6-23H2,1-5H3,(H,31,32)