2-methylsulfonyl-6-(1-prop-2-enylpiperidin-4-yl)benzenecarbonitrile

Systemtic Name: 2-methylsulfonyl-6-(1-prop-2-enylpiperidin-4-yl)benzenecarbonitrile Openeye Name: 2-(1-allyl-4-piperidyl)-6-methylsulfonyl-benzonitrile CAS Name: 2-methylsulfonyl-6-(1-prop-2-enyl-4-piperidinyl)benzonitrile IUPAC Name: 2-methylsulfonyl-6-(1-prop-2-enylpiperidin-4-yl)benzonitrile Traditional Name: 2-(1-allyl-4-piperidyl)-6-mesyl-benzonitrile Formula: C16H20N2O2S MolecularWeight: 304.4072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1C#N)C2CCN(CC2)CC=C

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1C#N)C2CCN(CC2)CC=C

InChI

InChI=1S/C16H20N2O2S/c1-3-9-18-10-7-13(8-11-18)14-5-4-6-16(15(14)12-17)21(2,19)20/h3-6,13H,1,7-11H2,2H3