4-azanyl-4-oxidanylidene-2-(3,5,5-trimethylhexanoylamino)butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-(3,5,5-trimethylhexanoylamino)butanoic acid Openeye Name: 4-amino-4-oxo-2-(3,5,5-trimethylhexanoylamino)butanoic acid CAS Name: 4-amino-4-oxo-2-[(3,5,5-trimethyl-1-oxohexyl)amino]butanoic acid IUPAC Name: 4-amino-4-oxo-2-(3,5,5-trimethylhexanoylamino)butanoic acid Traditional Name: 4-amino-4-keto-2-(3,5,5-trimethylhexanoylamino)butyric acid Formula: C13H24N2O4 MolecularWeight: 272.34066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H24N2O4/c1-8(7-13(2,3)4)5-11(17)15-9(12(18)19)6-10(14)16/h8-9H,5-7H2,1-4H3,(H2,14,16)(H,15,17)(H,18,19)