(2R)-2-(4,5-dimethyl-3-oxidanidyl-imidazol-3-ium-1-yl)-4-methyl-pentanoate

Systemtic Name: (2R)-2-(4,5-dimethyl-3-oxidanidyl-imidazol-3-ium-1-yl)-4-methyl-pentanoate Openeye Name: (2R)-2-(4,5-dimethyl-3-oxido-imidazol-3-ium-1-yl)-4-methyl-pentanoate CAS Name: (2R)-2-(4,5-dimethyl-3-oxido-1-imidazol-3-iumyl)-4-methylpentanoate IUPAC Name: (2R)-2-(4,5-dimethyl-3-oxidoimidazol-3-ium-1-yl)-4-methylpentanoate Traditional Name: (2R)-2-(4,5-dimethyl-3-oxido-imidazol-3-ium-1-yl)-4-methyl-valerate Formula: C11H17N2O3- MolecularWeight: 225.26428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=CN1C(CC(C)C)C(=O)[O-])[O-])C

Isomeric SMILES

CC1=C([N+](=CN1[C@H](CC(C)C)C(=O)[O-])[O-])C

InChI

InChI=1S/C11H18N2O3/c1-7(2)5-10(11(14)15)12-6-13(16)9(4)8(12)3/h6-7,10H,5H2,1-4H3,(H,14,15)/p-1/t10-/m1/s1