methyl (2R,3R)-12-(2,2-dimethylpropanoyloxy)-3-oxidanyl-2-prop-2-enyl-dodecanoate

Systemtic Name: methyl (2R,3R)-12-(2,2-dimethylpropanoyloxy)-3-oxidanyl-2-prop-2-enyl-dodecanoate Openeye Name: methyl (2R,3R)-2-allyl-12-(2,2-dimethylpropanoyloxy)-3-hydroxy-dodecanoate CAS Name: (2R,3R)-12-(2,2-dimethyl-1-oxopropoxy)-3-hydroxy-2-prop-2-enyldodecanoic acid methyl ester IUPAC Name: methyl (2R,3R)-12-(2,2-dimethylpropanoyloxy)-3-hydroxy-2-prop-2-enyldodecanoate Traditional Name: (2R)-2-[(1R)-1-hydroxy-10-pivaloyloxy-decyl]pent-4-enoic acid methyl ester Formula: C21H38O5 MolecularWeight: 370.52342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCCCCCCCCCC(C(CC=C)C(=O)OC)O

Isomeric SMILES

CC(C)(C)C(=O)OCCCCCCCCC[C@H]([C@@H](CC=C)C(=O)OC)O

InChI

InChI=1S/C21H38O5/c1-6-14-17(19(23)25-5)18(22)15-12-10-8-7-9-11-13-16-26-20(24)21(2,3)4/h6,17-18,22H,1,7-16H2,2-5H3/t17-,18-/m1/s1