3-[4-(3-methylbutyl)piperazin-1-yl]propanoic acid

Systemtic Name: 3-[4-(3-methylbutyl)piperazin-1-yl]propanoic acid Openeye Name: 3-(4-isopentylpiperazin-1-yl)propanoic acid CAS Name: 3-[4-(3-methylbutyl)-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-(3-methylbutyl)piperazin-1-yl]propanoic acid Traditional Name: 3-(4-isoamylpiperazino)propionic acid Formula: C12H24N2O2 MolecularWeight: 228.33116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CCN(CC1)CCC(=O)O

Isomeric SMILES

CC(C)CCN1CCN(CC1)CCC(=O)O

InChI

InChI=1S/C12H24N2O2/c1-11(2)3-5-13-7-9-14(10-8-13)6-4-12(15)16/h11H,3-10H2,1-2H3,(H,15,16)