2-azanyl-2-(4-azanylbutyl)-3-oxidanylidene-octanoic acid

Systemtic Name: 2-azanyl-2-(4-azanylbutyl)-3-oxidanylidene-octanoic acid Openeye Name: 2-amino-2-(4-aminobutyl)-3-oxo-octanoic acid CAS Name: 2-amino-2-(4-aminobutyl)-3-oxooctanoic acid IUPAC Name: 2-amino-2-(4-aminobutyl)-3-oxooctanoic acid Traditional Name: 2-amino-2-(4-aminobutyl)-3-keto-caprylic acid Formula: C12H24N2O3 MolecularWeight: 244.33056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(CCCCN)(C(=O)O)N

Isomeric SMILES

CCCCCC(=O)C(CCCCN)(C(=O)O)N

InChI

InChI=1S/C12H24N2O3/c1-2-3-4-7-10(15)12(14,11(16)17)8-5-6-9-13/h2-9,13-14H2,1H3,(H,16,17)