(2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-3-methyl-butanoate

Systemtic Name: (2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-3-methyl-butanoate Openeye Name: (2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-3-methyl-butanoate CAS Name: (2S)-2-[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]-3-methylbutanoate IUPAC Name: (2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-3-methylbutanoate Traditional Name: (2S)-2-[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]-3-methyl-butyrate Formula: C11H22N2O3 MolecularWeight: 230.30398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])[NH+]1CCN(CC1)CCO

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])[NH+]1CCN(CC1)CCO

InChI

InChI=1S/C11H22N2O3/c1-9(2)10(11(15)16)13-5-3-12(4-6-13)7-8-14/h9-10,14H,3-8H2,1-2H3,(H,15,16)/t10-/m0/s1