2-[2,5-bis(chloranyl)-3-methylsulfonyl-indol-1-yl]ethanenitrile

Systemtic Name: 2-[2,5-bis(chloranyl)-3-methylsulfonyl-indol-1-yl]ethanenitrile Openeye Name: 2-(2,5-dichloro-3-methylsulfonyl-indol-1-yl)acetonitrile CAS Name: 2-(2,5-dichloro-3-methylsulfonyl-1-indolyl)acetonitrile IUPAC Name: 2-(2,5-dichloro-3-methylsulfonylindol-1-yl)acetonitrile Traditional Name: 2-(2,5-dichloro-3-mesyl-indol-1-yl)acetonitrile Formula: C11H8Cl2N2O2S MolecularWeight: 303.16442

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(N(C2=C1C=C(C=C2)Cl)CC#N)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(N(C2=C1C=C(C=C2)Cl)CC#N)Cl

InChI

InChI=1S/C11H8Cl2N2O2S/c1-18(16,17)10-8-6-7(12)2-3-9(8)15(5-4-14)11(10)13/h2-3,6H,5H2,1H3