[(2S,3S,7R)-3,7-dimethyltridecan-2-yl] propanoate

Systemtic Name: [(2S,3S,7R)-3,7-dimethyltridecan-2-yl] propanoate Openeye Name: [(1S,2S,6R)-1,2,6-trimethyldodecyl] propanoate CAS Name: propanoic acid [(2S,3S,7R)-3,7-dimethyltridecan-2-yl] ester IUPAC Name: [(2S,3S,7R)-3,7-dimethyltridecan-2-yl] propanoate Traditional Name: propionic acid [(1S,2S,6R)-1,2,6-trimethyldodecyl] ester Formula: C18H36O2 MolecularWeight: 284.47724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCC[C@@H](C)CCC[C@H](C)[C@H](C)OC(=O)CC

InChI

InChI=1S/C18H36O2/c1-6-8-9-10-12-15(3)13-11-14-16(4)17(5)20-18(19)7-2/h15-17H,6-14H2,1-5H3/t15-,16+,17+/m1/s1