2-[1-(3-methoxypropyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-2,2-diphenyl-ethanenitrile

Systemtic Name: 2-[1-(3-methoxypropyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-2,2-diphenyl-ethanenitrile Openeye Name: 2-[1-(3-methoxypropyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-2,2-diphenyl-acetonitrile CAS Name: 2-[1-(3-methoxypropyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-2,2-diphenylacetonitrile IUPAC Name: 2-[1-(3-methoxypropyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-2,2-diphenylacetonitrile Traditional Name: 2-[1-(3-methoxypropyl)-1-azoniabicyclo[2.2.1]heptan-4-yl]-2,2-diphenyl-acetonitrile Formula: C24H29N2O+ MolecularWeight: 361.49986

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[N+]12CCC(C1)(CC2)C(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COCCC[N+]12CCC(C1)(CC2)C(C#N)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H29N2O/c1-27-18-8-15-26-16-13-23(20-26,14-17-26)24(19-25,21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-7,9-12H,8,13-18,20H2,1H3/q+1