4-(4,4,5,5-tetraethyl-1-oxidanidyl-3-oxidanyl-imidazol-1-ium-2-yl)benzoic acid

Systemtic Name: 4-(4,4,5,5-tetraethyl-1-oxidanidyl-3-oxidanyl-imidazol-1-ium-2-yl)benzoic acid Openeye Name: 4-(4,4,5,5-tetraethyl-1-hydroxy-3-oxido-imidazol-3-ium-2-yl)benzoic acid CAS Name: 4-(4,4,5,5-tetraethyl-1-hydroxy-3-oxido-2-imidazol-3-iumyl)benzoic acid IUPAC Name: 4-(4,4,5,5-tetraethyl-1-hydroxy-3-oxidoimidazol-3-ium-2-yl)benzoic acid Traditional Name: 4-(4,4,5,5-tetraethyl-1-hydroxy-3-oxido-2-imidazolin-3-ium-2-yl)benzoic acid Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C([N+](=C(N1O)C2=CC=C(C=C2)C(=O)O)[O-])(CC)CC)CC

Isomeric SMILES

CCC1(C([N+](=C(N1O)C2=CC=C(C=C2)C(=O)O)[O-])(CC)CC)CC

InChI

InChI=1S/C18H26N2O4/c1-5-17(6-2)18(7-3,8-4)20(24)15(19(17)23)13-9-11-14(12-10-13)16(21)22/h9-12,23H,5-8H2,1-4H3,(H,21,22)