4-[[[4-(4-chlorophenyl)-3-phenethyl-1H-imidazol-3-ium-2-yl]amino]methyl]-2,6-dimethoxy-phenol

Systemtic Name: 4-[[[4-(4-chlorophenyl)-3-phenethyl-1H-imidazol-3-ium-2-yl]amino]methyl]-2,6-dimethoxy-phenol Openeye Name: 4-[[[4-(4-chlorophenyl)-3-phenethyl-1H-imidazol-3-ium-2-yl]amino]methyl]-2,6-dimethoxy-phenol CAS Name: 4-[[[4-(4-chlorophenyl)-3-phenethyl-1H-imidazol-3-ium-2-yl]amino]methyl]-2,6-dimethoxyphenol IUPAC Name: 4-[[[4-(4-chlorophenyl)-3-phenethyl-1H-imidazol-3-ium-2-yl]amino]methyl]-2,6-dimethoxyphenol Traditional Name: 4-[[[4-(4-chlorophenyl)-3-phenethyl-1H-imidazol-3-ium-2-yl]amino]methyl]-2,6-dimethoxy-phenol Formula: C26H27ClN3O3+ MolecularWeight: 464.96388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)CNC2=[N+](C(=CN2)C3=CC=C(C=C3)Cl)CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)CNC2=[N+](C(=CN2)C3=CC=C(C=C3)Cl)CCC4=CC=CC=C4

InChI

InChI=1S/C26H26ClN3O3/c1-32-23-14-19(15-24(33-2)25(23)31)16-28-26-29-17-22(20-8-10-21(27)11-9-20)30(26)13-12-18-6-4-3-5-7-18/h3-11,14-15,17H,12-13,16H2,1-2H3,(H2,28,29,31)/p+1