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

Systemtic Name: 3-[4-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[2-oxo-2-(prop-2-ynylamino)ethyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[2-oxo-2-(prop-2-ynylamino)ethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[2-oxo-2-(prop-2-ynylamino)ethyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[2-keto-2-(propargylamino)ethyl]piperazino]propionic acid Formula: C12H19N3O3 MolecularWeight: 253.29756

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)CN1CCN(CC1)CCC(=O)O

Isomeric SMILES

C#CCNC(=O)CN1CCN(CC1)CCC(=O)O

InChI

InChI=1S/C12H19N3O3/c1-2-4-13-11(16)10-15-8-6-14(7-9-15)5-3-12(17)18/h1H,3-10H2,(H,13,16)(H,17,18)