4-[(9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonan-5-yl)sulfonyl]benzenecarbonitrile

Systemtic Name: 4-[(9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonan-5-yl)sulfonyl]benzenecarbonitrile Openeye Name: 4-[(9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonan-5-yl)sulfonyl]benzonitrile CAS Name: 4-[(9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonan-5-yl)sulfonyl]benzonitrile IUPAC Name: 4-[(9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonan-5-yl)sulfonyl]benzonitrile Traditional Name: 4-[(9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonan-5-yl)sulfonyl]benzonitrile Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CNCC1(CNC2)S(=O)(=O)C3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1(C2CNCC1(CNC2)S(=O)(=O)C3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C16H21N3O2S/c1-15(2)13-8-18-10-16(15,11-19-9-13)22(20,21)14-5-3-12(7-17)4-6-14/h3-6,13,18-19H,8-11H2,1-2H3