[1-[(3-methoxyphenyl)methyl]-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenyl-methanol

Systemtic Name: [1-[(3-methoxyphenyl)methyl]-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenyl-methanol Openeye Name: [1-[(3-methoxyphenyl)methyl]-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenyl-methanol CAS Name: [1-[(3-methoxyphenyl)methyl]-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenylmethanol IUPAC Name: [1-[(3-methoxyphenyl)methyl]-1-azoniabicyclo[2.2.1]heptan-4-yl]-diphenylmethanol Traditional Name: (1-m-anisyl-1-azoniabicyclo[2.2.1]heptan-4-yl)-diphenyl-methanol Formula: C27H30NO2+ MolecularWeight: 400.5326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[N+]23CCC(C2)(CC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O

Isomeric SMILES

COC1=CC=CC(=C1)C[N+]23CCC(C2)(CC3)C(C4=CC=CC=C4)(C5=CC=CC=C5)O

InChI

InChI=1S/C27H30NO2/c1-30-25-14-8-9-22(19-25)20-28-17-15-26(21-28,16-18-28)27(29,23-10-4-2-5-11-23)24-12-6-3-7-13-24/h2-14,19,29H,15-18,20-21H2,1H3/q+1