4-[12-[2-(hydroxymethyl)-2-methyl-3-oxidanyl-propanoyl]oxydodecanoyloxy]benzoic acid

Systemtic Name: 4-[12-[2-(hydroxymethyl)-2-methyl-3-oxidanyl-propanoyl]oxydodecanoyloxy]benzoic acid Openeye Name: 4-[12-[3-hydroxy-2-(hydroxymethyl)-2-methyl-propanoyl]oxydodecanoyloxy]benzoic acid CAS Name: 4-[12-[3-hydroxy-2-(hydroxymethyl)-2-methyl-1-oxopropoxy]-1-oxododecoxy]benzoic acid IUPAC Name: 4-[12-[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxydodecanoyloxy]benzoic acid Traditional Name: 4-[12-(3-hydroxy-2-methyl-2-methylol-propanoyl)oxydodecanoyloxy]benzoic acid Formula: C24H36O8 MolecularWeight: 452.53784

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)C(=O)OCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC(CO)(CO)C(=O)OCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C24H36O8/c1-24(17-25,18-26)23(30)31-16-10-8-6-4-2-3-5-7-9-11-21(27)32-20-14-12-19(13-15-20)22(28)29/h12-15,25-26H,2-11,16-18H2,1H3,(H,28,29)