2-[4-(2-ethylbutanoyl)piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(2-ethylbutanoyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(2-ethylbutanoyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(2-ethylbutanoyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(2-ethylbutanoyl)piperazino]acetic acid Formula: C12H22N2O3 MolecularWeight: 242.31468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22N2O3/c1-3-10(4-2)12(17)14-7-5-13(6-8-14)9-11(15)16/h10H,3-9H2,1-2H3,(H,15,16)