4-(2-fluorophenyl)-1-oxidanyl-5-(4-phenylbutyl)-1-(phenylmethyl)imidazol-1-ium

Systemtic Name: 4-(2-fluorophenyl)-1-oxidanyl-5-(4-phenylbutyl)-1-(phenylmethyl)imidazol-1-ium Openeye Name: 1-benzyl-4-(2-fluorophenyl)-1-hydroxy-5-(4-phenylbutyl)imidazol-1-ium CAS Name: 4-(2-fluorophenyl)-1-hydroxy-5-(4-phenylbutyl)-1-(phenylmethyl)imidazol-1-ium IUPAC Name: 1-benzyl-4-(2-fluorophenyl)-1-hydroxy-5-(4-phenylbutyl)imidazol-1-ium Traditional Name: 1-benzyl-4-(2-fluorophenyl)-1-hydroxy-5-(4-phenylbutyl)imidazol-1-ium Formula: C26H26FN2O+ MolecularWeight: 401.495843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCC2=C(N=C[N+]2(CC3=CC=CC=C3)O)C4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)CCCCC2=C(N=C[N+]2(CC3=CC=CC=C3)O)C4=CC=CC=C4F

InChI

InChI=1S/C26H26FN2O/c27-24-17-9-8-16-23(24)26-25(18-10-7-13-21-11-3-1-4-12-21)29(30,20-28-26)19-22-14-5-2-6-15-22/h1-6,8-9,11-12,14-17,20,30H,7,10,13,18-19H2/q+1