2-azanyl-2-butyl-3-oxidanylidene-octanoic acid

Systemtic Name: 2-azanyl-2-butyl-3-oxidanylidene-octanoic acid Openeye Name: 2-amino-2-butyl-3-oxo-octanoic acid CAS Name: 2-amino-2-butyl-3-oxooctanoic acid IUPAC Name: 2-amino-2-butyl-3-oxooctanoic acid Traditional Name: 2-amino-2-butyl-3-keto-caprylic acid Formula: C12H23NO3 MolecularWeight: 229.31592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(CCCC)(C(=O)O)N

Isomeric SMILES

CCCCCC(=O)C(CCCC)(C(=O)O)N

InChI

InChI=1S/C12H23NO3/c1-3-5-7-8-10(14)12(13,11(15)16)9-6-4-2/h3-9,13H2,1-2H3,(H,15,16)