2-[1-[(4,5-dimethyl-3-oxidanidyl-imidazol-3-ium-1-yl)methyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[(4,5-dimethyl-3-oxidanidyl-imidazol-3-ium-1-yl)methyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[(4,5-dimethyl-3-oxido-imidazol-3-ium-1-yl)methyl]cyclohexyl]acetic acid CAS Name: 2-[1-[(4,5-dimethyl-3-oxido-1-imidazol-3-iumyl)methyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[(4,5-dimethyl-3-oxidoimidazol-3-ium-1-yl)methyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[(4,5-dimethyl-3-oxido-imidazol-3-ium-1-yl)methyl]cyclohexyl]acetic acid Formula: C14H22N2O3 MolecularWeight: 266.33608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=CN1CC2(CCCCC2)CC(=O)O)[O-])C

Isomeric SMILES

CC1=C([N+](=CN1CC2(CCCCC2)CC(=O)O)[O-])C

InChI

InChI=1S/C14H22N2O3/c1-11-12(2)16(19)10-15(11)9-14(8-13(17)18)6-4-3-5-7-14/h10H,3-9H2,1-2H3,(H,17,18)