3-methyl-2-(3-oxidanidyl-4,5-diphenyl-imidazol-3-ium-1-yl)pentanoic acid

Systemtic Name: 3-methyl-2-(3-oxidanidyl-4,5-diphenyl-imidazol-3-ium-1-yl)pentanoic acid Openeye Name: 3-methyl-2-(3-oxido-4,5-diphenyl-imidazol-3-ium-1-yl)pentanoic acid CAS Name: 3-methyl-2-(3-oxido-4,5-diphenyl-1-imidazol-3-iumyl)pentanoic acid IUPAC Name: 3-methyl-2-(3-oxido-4,5-diphenylimidazol-3-ium-1-yl)pentanoic acid Traditional Name: 3-methyl-2-(3-oxido-4,5-diphenyl-imidazol-3-ium-1-yl)valeric acid Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)O)N1C=[N+](C(=C1C2=CC=CC=C2)C3=CC=CC=C3)[O-]

Isomeric SMILES

CCC(C)C(C(=O)O)N1C=[N+](C(=C1C2=CC=CC=C2)C3=CC=CC=C3)[O-]

InChI

InChI=1S/C21H22N2O3/c1-3-15(2)18(21(24)25)22-14-23(26)20(17-12-8-5-9-13-17)19(22)16-10-6-4-7-11-16/h4-15,18H,3H2,1-2H3,(H,24,25)