2-azanyl-3-oxidanylidene-decanoic acid; 1-octoxypropane-1,2,3-triol

Systemtic Name: 2-azanyl-3-oxidanylidene-decanoic acid; 1-octoxypropane-1,2,3-triol Openeye Name: 2-amino-3-oxo-decanoic acid; 1-octoxypropane-1,2,3-triol CAS Name: 2-amino-3-oxodecanoic acid; 1-octoxypropane-1,2,3-triol IUPAC Name: 2-amino-3-oxodecanoic acid; 1-octoxypropane-1,2,3-triol Traditional Name: 2-amino-3-keto-capric acid; 1-octoxypropane-1,2,3-triol Formula: C21H43NO7 MolecularWeight: 421.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(C(CO)O)O.CCCCCCCC(=O)C(C(=O)O)N

Isomeric SMILES

CCCCCCCCOC(C(CO)O)O.CCCCCCCC(=O)C(C(=O)O)N

InChI

InChI=1S/C11H24O4.C10H19NO3/c1-2-3-4-5-6-7-8-15-11(14)10(13)9-12;1-2-3-4-5-6-7-8(12)9(11)10(13)14/h10-14H,2-9H2,1H3;9H,2-7,11H2,1H3,(H,13,14)