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

Systemtic Name: N-[(2S)-1-(hexylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]henicosanamide Openeye Name: N-[(1S)-2-(hexylamino)-1-(hydroxymethyl)-2-oxo-ethyl]henicosanamide CAS Name: N-[(2S)-1-(hexylamino)-3-hydroxy-1-oxopropan-2-yl]heneicosanamide IUPAC Name: N-[(2S)-1-(hexylamino)-3-hydroxy-1-oxopropan-2-yl]henicosanamide Traditional Name: N-[(1S)-2-(hexylamino)-2-keto-1-methylol-ethyl]heneicosanamide Formula: C30H60N2O3 MolecularWeight: 496.809

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H60N2O3/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-29(34)32-28(27-33)30(35)31-26-24-8-6-4-2/h28,33H,3-27H2,1-2H3,(H,31,35)(H,32,34)/t28-/m0/s1