4-[2-methyl-3-[(4-methylphenyl)methyl]imidazol-3-ium-1-yl]-2,2-diphenyl-butanamide

Systemtic Name: 4-[2-methyl-3-[(4-methylphenyl)methyl]imidazol-3-ium-1-yl]-2,2-diphenyl-butanamide Openeye Name: 4-[2-methyl-3-(p-tolylmethyl)imidazol-3-ium-1-yl]-2,2-diphenyl-butanamide CAS Name: 4-[2-methyl-3-[(4-methylphenyl)methyl]-1-imidazol-3-iumyl]-2,2-diphenylbutanamide IUPAC Name: 4-[2-methyl-3-[(4-methylphenyl)methyl]imidazol-3-ium-1-yl]-2,2-diphenylbutanamide Traditional Name: 4-[2-methyl-3-(4-methylbenzyl)imidazol-3-ium-1-yl]-2,2-diphenyl-butyramide Formula: C28H30N3O+ MolecularWeight: 424.5573

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2=C(N(C=C2)CCC(C3=CC=CC=C3)(C4=CC=CC=C4)C(=O)N)C

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2=C(N(C=C2)CCC(C3=CC=CC=C3)(C4=CC=CC=C4)C(=O)N)C

InChI

InChI=1S/C28H29N3O/c1-22-13-15-24(16-14-22)21-31-20-19-30(23(31)2)18-17-28(27(29)32,25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-16,19-20H,17-18,21H2,1-2H3,(H-,29,32)/p+1