2-[1-(phenylsulfonyl)indol-3-yl]propanenitrile

Systemtic Name: 2-[1-(phenylsulfonyl)indol-3-yl]propanenitrile Openeye Name: 2-[1-(benzenesulfonyl)indol-3-yl]propanenitrile CAS Name: 2-[1-(benzenesulfonyl)-3-indolyl]propanenitrile IUPAC Name: 2-[1-(benzenesulfonyl)indol-3-yl]propanenitrile Traditional Name: 2-(1-besylindol-3-yl)propionitrile Formula: C17H14N2O2S MolecularWeight: 310.37026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C#N)C1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H14N2O2S/c1-13(11-18)16-12-19(17-10-6-5-9-15(16)17)22(20,21)14-7-3-2-4-8-14/h2-10,12-13H,1H3