1-(3-hexyl-4-oxidanylidene-oxetan-2-yl)heptan-2-yl 2-formamido-3-methyl-butanoate

Systemtic Name: 1-(3-hexyl-4-oxidanylidene-oxetan-2-yl)heptan-2-yl 2-formamido-3-methyl-butanoate Openeye Name: 1-[(3-hexyl-4-oxo-oxetan-2-yl)methyl]hexyl 2-formamido-3-methyl-butanoate CAS Name: 2-formamido-3-methylbutanoic acid 1-(3-hexyl-4-oxo-2-oxetanyl)heptan-2-yl ester IUPAC Name: 1-(3-hexyl-4-oxooxetan-2-yl)heptan-2-yl 2-formamido-3-methylbutanoate Traditional Name: 2-formamido-3-methyl-butyric acid 1-[(3-hexyl-4-keto-oxetan-2-yl)methyl]hexyl ester Formula: C22H39NO5 MolecularWeight: 397.54876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H39NO5/c1-5-7-9-11-13-18-19(28-21(18)25)14-17(12-10-8-6-2)27-22(26)20(16(3)4)23-15-24/h15-20H,5-14H2,1-4H3,(H,23,24)