2-(7-methyl-3-methylsulfonyl-indol-1-yl)ethanenitrile

Systemtic Name: 2-(7-methyl-3-methylsulfonyl-indol-1-yl)ethanenitrile Openeye Name: 2-(7-methyl-3-methylsulfonyl-indol-1-yl)acetonitrile CAS Name: 2-(7-methyl-3-methylsulfonyl-1-indolyl)acetonitrile IUPAC Name: 2-(7-methyl-3-methylsulfonylindol-1-yl)acetonitrile Traditional Name: 2-(3-mesyl-7-methyl-indol-1-yl)acetonitrile Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C=C2S(=O)(=O)C)CC#N

Isomeric SMILES

CC1=CC=CC2=C1N(C=C2S(=O)(=O)C)CC#N

InChI

InChI=1S/C12H12N2O2S/c1-9-4-3-5-10-11(17(2,15)16)8-14(7-6-13)12(9)10/h3-5,8H,7H2,1-2H3