bis(2-methylphenyl)-(1-oxidanidyl-1-azoniabicyclo[2.2.2]octan-3-yl)methanol

Systemtic Name: bis(2-methylphenyl)-(1-oxidanidyl-1-azoniabicyclo[2.2.2]octan-3-yl)methanol Openeye Name: bis-o-tolyl-(1-oxidoquinuclidin-1-ium-3-yl)methanol CAS Name: bis(2-methylphenyl)-(1-oxido-1-azoniabicyclo[2.2.2]octan-3-yl)methanol IUPAC Name: bis(2-methylphenyl)-(1-oxido-1-azoniabicyclo[2.2.2]octan-3-yl)methanol Traditional Name: bis-o-tolyl-(1-oxidoquinuclidin-1-ium-3-yl)methanol Formula: C22H27NO2 MolecularWeight: 337.45528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2C[N+]3(CCC2CC3)[O-])(C4=CC=CC=C4C)O

Isomeric SMILES

CC1=CC=CC=C1C(C2C[N+]3(CCC2CC3)[O-])(C4=CC=CC=C4C)O

InChI

InChI=1S/C22H27NO2/c1-16-7-3-5-9-19(16)22(24,20-10-6-4-8-17(20)2)21-15-23(25)13-11-18(21)12-14-23/h3-10,18,21,24H,11-15H2,1-2H3