[(2S)-1-[(2S,3S)-3-hexyl-4-oxidanylidene-oxetan-2-yl]hex-5-en-2-yl] (2S)-2-formamido-3-phenyl-propanoate

Systemtic Name: [(2S)-1-[(2S,3S)-3-hexyl-4-oxidanylidene-oxetan-2-yl]hex-5-en-2-yl] (2S)-2-formamido-3-phenyl-propanoate Openeye Name: [(1S)-1-[[(2S,3S)-3-hexyl-4-oxo-oxetan-2-yl]methyl]pent-4-enyl] (2S)-2-formamido-3-phenyl-propanoate CAS Name: (2S)-2-formamido-3-phenylpropanoic acid [(2S)-1-[(2S,3S)-3-hexyl-4-oxo-2-oxetanyl]hex-5-en-2-yl] ester IUPAC Name: [(2S)-1-[(2S,3S)-3-hexyl-4-oxooxetan-2-yl]hex-5-en-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]pent-4-enyl] ester Formula: C25H35NO5 MolecularWeight: 429.5491

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(OC1=O)CC(CCC=C)OC(=O)C(CC2=CC=CC=C2)NC=O

Isomeric SMILES

CCCCCC[C@H]1[C@@H](OC1=O)C[C@H](CCC=C)OC(=O)[C@H](CC2=CC=CC=C2)NC=O

InChI

InChI=1S/C25H35NO5/c1-3-5-7-11-15-21-23(31-24(21)28)17-20(14-6-4-2)30-25(29)22(26-18-27)16-19-12-9-8-10-13-19/h4,8-10,12-13,18,20-23H,2-3,5-7,11,14-17H2,1H3,(H,26,27)/t20-,21-,22-,23-/m0/s1