4-(3-methoxyphenyl)-4,5-dimethyl-1-(phenylmethyl)-1-azoniabicyclo[3.1.0]hexane

Systemtic Name: 4-(3-methoxyphenyl)-4,5-dimethyl-1-(phenylmethyl)-1-azoniabicyclo[3.1.0]hexane Openeye Name: 1-benzyl-4-(3-methoxyphenyl)-4,5-dimethyl-1-azoniabicyclo[3.1.0]hexane CAS Name: 4-(3-methoxyphenyl)-4,5-dimethyl-1-(phenylmethyl)-1-azoniabicyclo[3.1.0]hexane IUPAC Name: 1-benzyl-4-(3-methoxyphenyl)-4,5-dimethyl-1-azoniabicyclo[3.1.0]hexane Traditional Name: 1-benzyl-4-(3-methoxyphenyl)-4,5-dimethyl-1-azoniabicyclo[3.1.0]hexane Formula: C21H26NO+ MolecularWeight: 308.43724

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC[N+]2(C1(C2)C)CC3=CC=CC=C3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1(CC[N+]2(C1(C2)C)CC3=CC=CC=C3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C21H26NO/c1-20(18-10-7-11-19(14-18)23-3)12-13-22(16-21(20,22)2)15-17-8-5-4-6-9-17/h4-11,14H,12-13,15-16H2,1-3H3/q+1