1-methyl-5-oxidanyl-3-(phenylmethyl)imidazol-1-ium-4-carboxamide

Systemtic Name: 1-methyl-5-oxidanyl-3-(phenylmethyl)imidazol-1-ium-4-carboxamide Openeye Name: 3-benzyl-5-hydroxy-1-methyl-imidazol-1-ium-4-carboxamide CAS Name: 5-hydroxy-1-methyl-3-(phenylmethyl)-4-imidazol-1-iumcarboxamide IUPAC Name: 3-benzyl-5-hydroxy-1-methylimidazol-1-ium-4-carboxamide Traditional Name: 3-benzyl-5-hydroxy-1-methyl-imidazol-1-ium-4-carboxamide Formula: C12H14N3O2+ MolecularWeight: 232.25846

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C(=C1O)C(=O)N)CC2=CC=CC=C2

Isomeric SMILES

C[N+]1=CN(C(=C1O)C(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C12H13N3O2/c1-14-8-15(10(11(13)16)12(14)17)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H2-,13,16,17)/p+1