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

Systemtic Name: 5-[4,4-bis(4-methoxyphenyl)butyl]-1-oxidanyl-1-(phenylmethyl)imidazol-1-ium Openeye Name: 1-benzyl-5-[4,4-bis(4-methoxyphenyl)butyl]-1-hydroxy-imidazol-1-ium CAS Name: 5-[4,4-bis(4-methoxyphenyl)butyl]-1-hydroxy-1-(phenylmethyl)imidazol-1-ium IUPAC Name: 1-benzyl-5-[4,4-bis(4-methoxyphenyl)butyl]-1-hydroxyimidazol-1-ium Traditional Name: 1-benzyl-5-[4,4-bis(4-methoxyphenyl)butyl]-1-hydroxy-imidazol-1-ium Formula: C28H31N2O3+ MolecularWeight: 443.55734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CCCC2=CN=C[N+]2(CC3=CC=CC=C3)O)C4=CC=C(C=C4)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(CCCC2=CN=C[N+]2(CC3=CC=CC=C3)O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C28H31N2O3/c1-32-26-15-11-23(12-16-26)28(24-13-17-27(33-2)18-14-24)10-6-9-25-19-29-21-30(25,31)20-22-7-4-3-5-8-22/h3-5,7-8,11-19,21,28,31H,6,9-10,20H2,1-2H3/q+1