4-(4-ethylphenyl)-1-oxidanyl-5-(4-phenylbutyl)-1-(phenylmethyl)imidazol-1-ium

Systemtic Name: 4-(4-ethylphenyl)-1-oxidanyl-5-(4-phenylbutyl)-1-(phenylmethyl)imidazol-1-ium Openeye Name: 1-benzyl-4-(4-ethylphenyl)-1-hydroxy-5-(4-phenylbutyl)imidazol-1-ium CAS Name: 4-(4-ethylphenyl)-1-hydroxy-5-(4-phenylbutyl)-1-(phenylmethyl)imidazol-1-ium IUPAC Name: 1-benzyl-4-(4-ethylphenyl)-1-hydroxy-5-(4-phenylbutyl)imidazol-1-ium Traditional Name: 1-benzyl-4-(4-ethylphenyl)-1-hydroxy-5-(4-phenylbutyl)imidazol-1-ium Formula: C28H31N2O+ MolecularWeight: 411.55854

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C([N+](C=N2)(CC3=CC=CC=C3)O)CCCCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C([N+](C=N2)(CC3=CC=CC=C3)O)CCCCC4=CC=CC=C4

InChI

InChI=1S/C28H31N2O/c1-2-23-17-19-26(20-18-23)28-27(16-10-9-13-24-11-5-3-6-12-24)30(31,22-29-28)21-25-14-7-4-8-15-25/h3-8,11-12,14-15,17-20,22,31H,2,9-10,13,16,21H2,1H3/q+1