2,2-diethyl-4-oxidanylidene-4-(prop-2-ynylamino)butanoic acid

Systemtic Name: 2,2-diethyl-4-oxidanylidene-4-(prop-2-ynylamino)butanoic acid Openeye Name: 2,2-diethyl-4-oxo-4-(prop-2-ynylamino)butanoic acid CAS Name: 2,2-diethyl-4-oxo-4-(prop-2-ynylamino)butanoic acid IUPAC Name: 2,2-diethyl-4-oxo-4-(prop-2-ynylamino)butanoic acid Traditional Name: 2,2-diethyl-4-keto-4-(propargylamino)butyric acid Formula: C11H17NO3 MolecularWeight: 211.25758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC(=O)NCC#C)C(=O)O

Isomeric SMILES

CCC(CC)(CC(=O)NCC#C)C(=O)O

InChI

InChI=1S/C11H17NO3/c1-4-7-12-9(13)8-11(5-2,6-3)10(14)15/h1H,5-8H2,2-3H3,(H,12,13)(H,14,15)