[(2R)-1-[(2S,3R)-3-hexyl-4-oxidanylidene-oxetan-2-yl]hex-5-en-2-yl] (2R)-2-formamido-3-methyl-butanoate

Systemtic Name: [(2R)-1-[(2S,3R)-3-hexyl-4-oxidanylidene-oxetan-2-yl]hex-5-en-2-yl] (2R)-2-formamido-3-methyl-butanoate Openeye Name: [(1R)-1-[[(2S,3R)-3-hexyl-4-oxo-oxetan-2-yl]methyl]pent-4-enyl] (2R)-2-formamido-3-methyl-butanoate CAS Name: (2R)-2-formamido-3-methylbutanoic acid [(2R)-1-[(2S,3R)-3-hexyl-4-oxo-2-oxetanyl]hex-5-en-2-yl] ester IUPAC Name: [(2R)-1-[(2S,3R)-3-hexyl-4-oxooxetan-2-yl]hex-5-en-2-yl] (2R)-2-formamido-3-methylbutanoate Traditional Name: (2R)-2-formamido-3-methyl-butyric acid [(1R)-1-[[(2S,3R)-3-hexyl-4-keto-oxetan-2-yl]methyl]pent-4-enyl] ester Formula: C21H35NO5 MolecularWeight: 381.5063

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(OC1=O)CC(CCC=C)OC(=O)C(C(C)C)NC=O

Isomeric SMILES

CCCCCC[C@@H]1[C@@H](OC1=O)C[C@@H](CCC=C)OC(=O)[C@@H](C(C)C)NC=O

InChI

InChI=1S/C21H35NO5/c1-5-7-9-10-12-17-18(27-20(17)24)13-16(11-8-6-2)26-21(25)19(15(3)4)22-14-23/h6,14-19H,2,5,7-13H2,1,3-4H3,(H,22,23)/t16-,17-,18+,19-/m1/s1