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

Systemtic Name: 3-[4-[2-oxidanylidene-2-(pentan-2-ylamino)ethyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[2-(1-methylbutylamino)-2-oxo-ethyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[2-oxo-2-(pentan-2-ylamino)ethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[2-oxo-2-(pentan-2-ylamino)ethyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[2-keto-2-(1-methylbutylamino)ethyl]piperazino]propionic acid Formula: C14H27N3O3 MolecularWeight: 285.38248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H27N3O3/c1-3-4-12(2)15-13(18)11-17-9-7-16(8-10-17)6-5-14(19)20/h12H,3-11H2,1-2H3,(H,15,18)(H,19,20)