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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C(C)N1CCN(CC1)CCC(=O)O

Isomeric SMILES

CCC(C)NC(=O)C(C)N1CCN(CC1)CCC(=O)O

InChI

InChI=1S/C14H27N3O3/c1-4-11(2)15-14(20)12(3)17-9-7-16(8-10-17)6-5-13(18)19/h11-12H,4-10H2,1-3H3,(H,15,20)(H,18,19)