[(2S)-1-[(2R,3R)-3-hexyl-4-oxidanylidene-oxetan-2-yl]pentadecan-2-yl] (2S)-2-formamido-4-methyl-pentanoate

Systemtic Name: [(2S)-1-[(2R,3R)-3-hexyl-4-oxidanylidene-oxetan-2-yl]pentadecan-2-yl] (2S)-2-formamido-4-methyl-pentanoate Openeye Name: [(1S)-1-[[(2R,3R)-3-hexyl-4-oxo-oxetan-2-yl]methyl]tetradecyl] (2S)-2-formamido-4-methyl-pentanoate CAS Name: (2S)-2-formamido-4-methylpentanoic acid [(2S)-1-[(2R,3R)-3-hexyl-4-oxo-2-oxetanyl]pentadecan-2-yl] ester IUPAC Name: [(2S)-1-[(2R,3R)-3-hexyl-4-oxooxetan-2-yl]pentadecan-2-yl] (2S)-2-formamido-4-methylpentanoate Traditional Name: (2S)-2-formamido-4-methyl-valeric acid [(1S)-1-[[(2R,3R)-3-hexyl-4-keto-oxetan-2-yl]methyl]tetradecyl] ester Formula: C31H57NO5 MolecularWeight: 523.78798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC1C(C(=O)O1)CCCCCC)OC(=O)C(CC(C)C)NC=O

Isomeric SMILES

CCCCCCCCCCCCC[C@@H](C[C@@H]1[C@H](C(=O)O1)CCCCCC)OC(=O)[C@H](CC(C)C)NC=O

InChI

InChI=1S/C31H57NO5/c1-5-7-9-11-12-13-14-15-16-17-18-20-26(36-31(35)28(32-24-33)22-25(3)4)23-29-27(30(34)37-29)21-19-10-8-6-2/h24-29H,5-23H2,1-4H3,(H,32,33)/t26-,27+,28-,29+/m0/s1