5-[4,4-bis(4-methylphenyl)butyl]-1-oxidanyl-1-(phenylmethyl)imidazol-1-ium

Systemtic Name: 5-[4,4-bis(4-methylphenyl)butyl]-1-oxidanyl-1-(phenylmethyl)imidazol-1-ium Openeye Name: 1-benzyl-5-[4,4-bis(p-tolyl)butyl]-1-hydroxy-imidazol-1-ium CAS Name: 5-[4,4-bis(4-methylphenyl)butyl]-1-hydroxy-1-(phenylmethyl)imidazol-1-ium IUPAC Name: 1-benzyl-5-[4,4-bis(4-methylphenyl)butyl]-1-hydroxyimidazol-1-ium Traditional Name: 1-benzyl-5-[4,4-bis(p-tolyl)butyl]-1-hydroxy-imidazol-1-ium Formula: C28H31N2O+ MolecularWeight: 411.55854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CCCC2=CN=C[N+]2(CC3=CC=CC=C3)O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CCCC2=CN=C[N+]2(CC3=CC=CC=C3)O)C4=CC=C(C=C4)C

InChI

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