2-[5-chloranyl-1-(4-methylphenyl)sulfonyl-indol-4-yl]ethanenitrile

Systemtic Name: 2-[5-chloranyl-1-(4-methylphenyl)sulfonyl-indol-4-yl]ethanenitrile Openeye Name: 2-[5-chloro-1-(p-tolylsulfonyl)indol-4-yl]acetonitrile CAS Name: 2-[5-chloro-1-(4-methylphenyl)sulfonyl-4-indolyl]acetonitrile IUPAC Name: 2-[5-chloro-1-(4-methylphenyl)sulfonylindol-4-yl]acetonitrile Traditional Name: 2-(5-chloro-1-tosyl-indol-4-yl)acetonitrile Formula: C17H13ClN2O2S MolecularWeight: 344.81532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC(=C3CC#N)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2C=CC(=C3CC#N)Cl

InChI

InChI=1S/C17H13ClN2O2S/c1-12-2-4-13(5-3-12)23(21,22)20-11-9-15-14(8-10-19)16(18)6-7-17(15)20/h2-7,9,11H,8H2,1H3