3-[[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]amino]propanoic acid

Systemtic Name: 3-[[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]amino]propanoic acid Openeye Name: 3-[[2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl]amino]propanoic acid CAS Name: 3-[[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]amino]propanoic acid Traditional Name: 3-[[2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl]amino]propionic acid Formula: C12H20N2O3 MolecularWeight: 240.2988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CNCCC(=O)O

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CNCCC(=O)O

InChI

InChI=1S/C12H20N2O3/c1-4-12(5-2,6-3)14-10(15)9-13-8-7-11(16)17/h1,13H,5-9H2,2-3H3,(H,14,15)(H,16,17)