3-azanyl-4-octadecanoyloxy-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-octadecanoyloxy-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-octadecanoyloxy-4-oxo-butanoic acid CAS Name: 3-amino-4-oxo-4-(1-oxooctadecoxy)butanoic acid IUPAC Name: 3-amino-4-octadecanoyloxy-4-oxobutanoic acid Traditional Name: 3-amino-4-keto-4-stearoyloxy-butyric acid Formula: C22H41NO5 MolecularWeight: 399.56464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(=O)C(CC(=O)O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(=O)C(CC(=O)O)N

InChI

InChI=1S/C22H41NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(26)28-22(27)19(23)18-20(24)25/h19H,2-18,23H2,1H3,(H,24,25)