3-[4-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[2-(isopropylamino)-2-oxo-ethyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[2-oxo-2-(propan-2-ylamino)ethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[2-oxo-2-(propan-2-ylamino)ethyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[2-(isopropylamino)-2-keto-ethyl]piperazino]propionic acid Formula: C12H23N3O3 MolecularWeight: 257.32932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1CCN(CC1)CCC(=O)O

Isomeric SMILES

CC(C)NC(=O)CN1CCN(CC1)CCC(=O)O

InChI

InChI=1S/C12H23N3O3/c1-10(2)13-11(16)9-15-7-5-14(6-8-15)4-3-12(17)18/h10H,3-9H2,1-2H3,(H,13,16)(H,17,18)