2-[4-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[2-oxo-2-(sec-butylamino)ethyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[2-(butan-2-ylamino)-2-oxoethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[2-(butan-2-ylamino)-2-oxoethyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[2-keto-2-(sec-butylamino)ethyl]piperazino]acetic acid Formula: C12H23N3O3 MolecularWeight: 257.32932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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