[(2S)-1-[(2S,3S)-3-ethyl-4-oxidanylidene-oxetan-2-yl]nonadecan-2-yl] (2S)-2-formamido-4-methyl-pentanoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(CC1C(C(=O)O1)CC)OC(=O)C(CC(C)C)NC=O

Isomeric SMILES

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

InChI

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