4-azanyl-3-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-azanyl-3-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]benzenecarbonitrile Openeye Name: 4-amino-3-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]benzonitrile CAS Name: 4-amino-3-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]benzonitrile IUPAC Name: 4-amino-3-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]benzonitrile Traditional Name: 4-amino-3-[(8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]benzonitrile Formula: C16H22N3+ MolecularWeight: 256.36598

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C2CCCC1CC2)CC3=C(C=CC(=C3)C#N)N

Isomeric SMILES

C[N+]1(C2CCCC1CC2)CC3=C(C=CC(=C3)C#N)N

InChI

InChI=1S/C16H22N3/c1-19(14-3-2-4-15(19)7-6-14)11-13-9-12(10-17)5-8-16(13)18/h5,8-9,14-15H,2-4,6-7,11,18H2,1H3/q+1