3-[(3-tert-butyl-4-methoxy-phenyl)methyl]-1H-imidazol-3-ium

Systemtic Name: 3-[(3-tert-butyl-4-methoxy-phenyl)methyl]-1H-imidazol-3-ium Openeye Name: 3-[(3-tert-butyl-4-methoxy-phenyl)methyl]-1H-imidazol-3-ium CAS Name: 3-[(3-tert-butyl-4-methoxyphenyl)methyl]-1H-imidazol-3-ium IUPAC Name: 3-[(3-tert-butyl-4-methoxyphenyl)methyl]-1H-imidazol-3-ium Traditional Name: 3-(3-tert-butyl-4-methoxy-benzyl)-1H-imidazol-3-ium Formula: C15H21N2O+ MolecularWeight: 245.34004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C[N+]2=CNC=C2)OC

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C[N+]2=CNC=C2)OC

InChI

InChI=1S/C15H20N2O/c1-15(2,3)13-9-12(5-6-14(13)18-4)10-17-8-7-16-11-17/h5-9,11H,10H2,1-4H3/p+1