2-methyl-2-[(Z)-12-oxidanyloctadec-9-enoyl]oxy-propanoic acid

Systemtic Name: 2-methyl-2-[(Z)-12-oxidanyloctadec-9-enoyl]oxy-propanoic acid Openeye Name: 2-[(Z)-12-hydroxyoctadec-9-enoyl]oxy-2-methyl-propanoic acid CAS Name: 2-[(Z)-12-hydroxy-1-oxooctadec-9-enoxy]-2-methylpropanoic acid IUPAC Name: 2-[(Z)-12-hydroxyoctadec-9-enoyl]oxy-2-methylpropanoic acid Traditional Name: 2-[(Z)-12-hydroxyoctadec-9-enoyl]oxy-2-methyl-propionic acid Formula: C22H40O5 MolecularWeight: 384.55

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)OC(C)(C)C(=O)O)O

Isomeric SMILES

CCCCCCC(C/C=C\CCCCCCCC(=O)OC(C)(C)C(=O)O)O

InChI

InChI=1S/C22H40O5/c1-4-5-6-13-16-19(23)17-14-11-9-7-8-10-12-15-18-20(24)27-22(2,3)21(25)26/h11,14,19,23H,4-10,12-13,15-18H2,1-3H3,(H,25,26)/b14-11-