N-[(2S)-1-(hexylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]octadecanamide

Systemtic Name: N-[(2S)-1-(hexylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]octadecanamide Openeye Name: N-[(1S)-2-(hexylamino)-1-(hydroxymethyl)-2-oxo-ethyl]octadecanamide CAS Name: N-[(2S)-1-(hexylamino)-3-hydroxy-1-oxopropan-2-yl]octadecanamide IUPAC Name: N-[(2S)-1-(hexylamino)-3-hydroxy-1-oxopropan-2-yl]octadecanamide Traditional Name: N-[(1S)-2-(hexylamino)-2-keto-1-methylol-ethyl]stearamide Formula: C27H54N2O3 MolecularWeight: 454.72926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(CO)C(=O)NCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)NCCCCCC

InChI

InChI=1S/C27H54N2O3/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-22-26(31)29-25(24-30)27(32)28-23-21-8-6-4-2/h25,30H,3-24H2,1-2H3,(H,28,32)(H,29,31)/t25-/m0/s1