[(2S)-1-[(2S,3S)-3-hexyl-4-oxidanylidene-oxetan-2-yl]pentadecan-2-yl] (2S)-2-formamido-3-phenyl-propanoate

Systemtic Name: [(2S)-1-[(2S,3S)-3-hexyl-4-oxidanylidene-oxetan-2-yl]pentadecan-2-yl] (2S)-2-formamido-3-phenyl-propanoate Openeye Name: [(1S)-1-[[(2S,3S)-3-hexyl-4-oxo-oxetan-2-yl]methyl]tetradecyl] (2S)-2-formamido-3-phenyl-propanoate CAS Name: (2S)-2-formamido-3-phenylpropanoic acid [(2S)-1-[(2S,3S)-3-hexyl-4-oxo-2-oxetanyl]pentadecan-2-yl] ester IUPAC Name: [(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]pentadecan-2-yl] (2S)-2-formamido-3-phenylpropanoate Traditional Name: (2S)-2-formamido-3-phenyl-propionic acid [(1S)-1-[[(2S,3S)-3-hexyl-4-keto-oxetan-2-yl]methyl]tetradecyl] ester Formula: C34H55NO5 MolecularWeight: 557.8042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC1C(C(=O)O1)CCCCCC)OC(=O)C(CC2=CC=CC=C2)NC=O

Isomeric SMILES

CCCCCCCCCCCCC[C@@H](C[C@H]1[C@@H](C(=O)O1)CCCCCC)OC(=O)[C@H](CC2=CC=CC=C2)NC=O

InChI

InChI=1S/C34H55NO5/c1-3-5-7-9-10-11-12-13-14-15-19-23-29(26-32-30(33(37)40-32)24-20-8-6-4-2)39-34(38)31(35-27-36)25-28-21-17-16-18-22-28/h16-18,21-22,27,29-32H,3-15,19-20,23-26H2,1-2H3,(H,35,36)/t29-,30-,31-,32-/m0/s1