3-[4-[1-oxidanylidene-1-(prop-2-ynylamino)propan-2-yl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[1-oxidanylidene-1-(prop-2-ynylamino)propan-2-yl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[1-methyl-2-oxo-2-(prop-2-ynylamino)ethyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[1-oxo-1-(prop-2-ynylamino)propan-2-yl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[1-oxo-1-(prop-2-ynylamino)propan-2-yl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[2-keto-1-methyl-2-(propargylamino)ethyl]piperazino]propionic acid Formula: C13H21N3O3 MolecularWeight: 267.32414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC#C)N1CCN(CC1)CCC(=O)O

Isomeric SMILES

CC(C(=O)NCC#C)N1CCN(CC1)CCC(=O)O

InChI

InChI=1S/C13H21N3O3/c1-3-5-14-13(19)11(2)16-9-7-15(8-10-16)6-4-12(17)18/h1,11H,4-10H2,2H3,(H,14,19)(H,17,18)