3-[4-(4-oxidanyl-4-oxidanylidene-butan-2-yl)piperazin-1-yl]butanoic acid

Systemtic Name: 3-[4-(4-oxidanyl-4-oxidanylidene-butan-2-yl)piperazin-1-yl]butanoic acid Openeye Name: 3-[4-(3-hydroxy-1-methyl-3-oxo-propyl)piperazin-1-yl]butanoic acid CAS Name: 3-[4-(4-hydroxy-4-oxobutan-2-yl)-1-piperazinyl]butanoic acid IUPAC Name: 3-[4-(4-hydroxy-4-oxobutan-2-yl)piperazin-1-yl]butanoic acid Traditional Name: 3-[4-(3-hydroxy-3-keto-1-methyl-propyl)piperazino]butyric acid Formula: C12H22N2O4 MolecularWeight: 258.31408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22N2O4/c1-9(7-11(15)16)13-3-5-14(6-4-13)10(2)8-12(17)18/h9-10H,3-8H2,1-2H3,(H,15,16)(H,17,18)