4-azanyl-2-(hexanoylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-(hexanoylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-(hexanoylamino)-4-oxo-butanoic acid CAS Name: 4-amino-4-oxo-2-(1-oxohexylamino)butanoic acid IUPAC Name: 4-amino-2-(hexanoylamino)-4-oxobutanoic acid Traditional Name: 4-amino-2-(caproylamino)-4-keto-butyric acid Formula: C10H18N2O4 MolecularWeight: 230.26092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

CCCCCC(=O)NC(CC(=O)N)C(=O)O

InChI

InChI=1S/C10H18N2O4/c1-2-3-4-5-9(14)12-7(10(15)16)6-8(11)13/h7H,2-6H2,1H3,(H2,11,13)(H,12,14)(H,15,16)