(2S)-2-azanyl-3-methyl-N-[(2S,3R)-3-oxidanyloctadecan-2-yl]butanamide

Systemtic Name: (2S)-2-azanyl-3-methyl-N-[(2S,3R)-3-oxidanyloctadecan-2-yl]butanamide Openeye Name: (2S)-2-amino-N-[(1S,2R)-2-hydroxy-1-methyl-heptadecyl]-3-methyl-butanamide CAS Name: (2S)-2-amino-N-[(2S,3R)-3-hydroxyoctadecan-2-yl]-3-methylbutanamide IUPAC Name: (2S)-2-amino-N-[(2S,3R)-3-hydroxyoctadecan-2-yl]-3-methylbutanamide Traditional Name: (2S)-2-amino-N-[(1S,2R)-2-hydroxy-1-methyl-heptadecyl]-3-methyl-butyramide Formula: C23H48N2O2 MolecularWeight: 384.63942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C(C)NC(=O)C(C(C)C)N)O

Isomeric SMILES

CCCCCCCCCCCCCCC[C@H]([C@H](C)NC(=O)[C@H](C(C)C)N)O

InChI

InChI=1S/C23H48N2O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(26)20(4)25-23(27)22(24)19(2)3/h19-22,26H,5-18,24H2,1-4H3,(H,25,27)/t20-,21+,22-/m0/s1