(Z)-3-(1-oxidanylcyclododecyl)-2-[tris(1-oxidanylcyclododecyl)methyl]prop-2-enoic acid

Systemtic Name: (Z)-3-(1-oxidanylcyclododecyl)-2-[tris(1-oxidanylcyclododecyl)methyl]prop-2-enoic acid Openeye Name: (Z)-3-(1-hydroxycyclododecyl)-2-[tris(1-hydroxycyclododecyl)methyl]prop-2-enoic acid CAS Name: (Z)-3-(1-hydroxycyclododecyl)-2-[tris(1-hydroxycyclododecyl)methyl]-2-propenoic acid IUPAC Name: (Z)-3-(1-hydroxycyclododecyl)-2-[tris(1-hydroxycyclododecyl)methyl]prop-2-enoic acid Traditional Name: (Z)-3-(1-hydroxycyclododecyl)-2-[tris(1-hydroxycyclododecyl)methyl]acrylic acid Formula: C52H94O6 MolecularWeight: 815.29916

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)(C=C(C(=O)O)C(C2(CCCCCCCCCCC2)O)(C3(CCCCCCCCCCC3)O)C4(CCCCCCCCCCC4)O)O

Isomeric SMILES

C1CCCCCC(CCCCC1)(/C=C(\C(=O)O)/C(C2(CCCCCCCCCCC2)O)(C3(CCCCCCCCCCC3)O)C4(CCCCCCCCCCC4)O)O

InChI

InChI=1S/C52H94O6/c53-47(54)46(45-48(55)37-29-21-13-5-1-6-14-22-30-38-48)52(49(56)39-31-23-15-7-2-8-16-24-32-40-49,50(57)41-33-25-17-9-3-10-18-26-34-42-50)51(58)43-35-27-19-11-4-12-20-28-36-44-51/h45,55-58H,1-44H2,(H,53,54)/b46-45+