1-(3-hexadecyl-4-oxidanylidene-oxetan-2-yl)propan-2-yl 2-formamido-4-methyl-pentanoate

Systemtic Name: 1-(3-hexadecyl-4-oxidanylidene-oxetan-2-yl)propan-2-yl 2-formamido-4-methyl-pentanoate Openeye Name: [2-(3-hexadecyl-4-oxo-oxetan-2-yl)-1-methyl-ethyl] 2-formamido-4-methyl-pentanoate CAS Name: 2-formamido-4-methylpentanoic acid 1-(3-hexadecyl-4-oxo-2-oxetanyl)propan-2-yl ester IUPAC Name: 1-(3-hexadecyl-4-oxooxetan-2-yl)propan-2-yl 2-formamido-4-methylpentanoate Traditional Name: 2-formamido-4-methyl-valeric acid [2-(3-cetyl-4-keto-oxetan-2-yl)-1-methyl-ethyl] ester Formula: C29H53NO5 MolecularWeight: 495.73482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1C(OC1=O)CC(C)OC(=O)C(CC(C)C)NC=O

Isomeric SMILES

CCCCCCCCCCCCCCCCC1C(OC1=O)CC(C)OC(=O)C(CC(C)C)NC=O

InChI

InChI=1S/C29H53NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-27(35-28(25)32)21-24(4)34-29(33)26(30-22-31)20-23(2)3/h22-27H,5-21H2,1-4H3,(H,30,31)