2-azanyl-4-methyl-3-oxidanyl-octanoic acid

Systemtic Name: 2-azanyl-4-methyl-3-oxidanyl-octanoic acid Openeye Name: 2-amino-3-hydroxy-4-methyl-octanoic acid CAS Name: 2-amino-3-hydroxy-4-methyloctanoic acid IUPAC Name: 2-amino-3-hydroxy-4-methyloctanoic acid Traditional Name: 2-amino-3-hydroxy-4-methyl-caprylic acid Formula: C9H19NO3 MolecularWeight: 189.25206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C(C(C(=O)O)N)O

Isomeric SMILES

CCCCC(C)C(C(C(=O)O)N)O

InChI

InChI=1S/C9H19NO3/c1-3-4-5-6(2)8(11)7(10)9(12)13/h6-8,11H,3-5,10H2,1-2H3,(H,12,13)