3-(9,9-dimethyl-3-oxa-9-azoniabicyclo[3.3.1]nonan-7-yl)-2,2-diphenyl-propanenitrile

Systemtic Name: 3-(9,9-dimethyl-3-oxa-9-azoniabicyclo[3.3.1]nonan-7-yl)-2,2-diphenyl-propanenitrile Openeye Name: 3-(9,9-dimethyl-3-oxa-9-azoniabicyclo[3.3.1]nonan-7-yl)-2,2-diphenyl-propanenitrile CAS Name: 3-(9,9-dimethyl-3-oxa-9-azoniabicyclo[3.3.1]nonan-7-yl)-2,2-diphenylpropanenitrile IUPAC Name: 3-(9,9-dimethyl-3-oxa-9-azoniabicyclo[3.3.1]nonan-7-yl)-2,2-diphenylpropanenitrile Traditional Name: 3-(9,9-dimethyl-3-oxa-9-azoniabicyclo[3.3.1]nonan-7-yl)-2,2-diphenyl-propionitrile Formula: C24H29N2O+ MolecularWeight: 361.49986

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2CC(CC1COC2)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

C[N+]1(C2CC(CC1COC2)CC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C24H29N2O/c1-26(2)22-13-19(14-23(26)17-27-16-22)15-24(18-25,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,19,22-23H,13-17H2,1-2H3/q+1