ethyl 5-azanyl-3-methyl-1-(phenylmethyl)imidazol-1-ium-4-carboxylate

Systemtic Name: ethyl 5-azanyl-3-methyl-1-(phenylmethyl)imidazol-1-ium-4-carboxylate Openeye Name: ethyl 5-amino-1-benzyl-3-methyl-imidazol-1-ium-4-carboxylate CAS Name: 5-amino-3-methyl-1-(phenylmethyl)-4-imidazol-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-benzyl-3-methylimidazol-1-ium-4-carboxylate Traditional Name: 5-amino-1-benzyl-3-methyl-imidazol-1-ium-4-carboxylic acid ethyl ester Formula: C14H18N3O2+ MolecularWeight: 260.31162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C([N+](=CN1C)CC2=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)C1=C([N+](=CN1C)CC2=CC=CC=C2)N

InChI

InChI=1S/C14H17N3O2/c1-3-19-14(18)12-13(15)17(10-16(12)2)9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H-,15,18)/p+1