2-[4-[4-(cyanomethoxy)-3-methyl-phenyl]sulfonyl-2-methyl-phenoxy]ethanenitrile

Systemtic Name: 2-[4-[4-(cyanomethoxy)-3-methyl-phenyl]sulfonyl-2-methyl-phenoxy]ethanenitrile Openeye Name: 2-[4-[4-(cyanomethoxy)-3-methyl-phenyl]sulfonyl-2-methyl-phenoxy]acetonitrile CAS Name: 2-[4-[4-(cyanomethoxy)-3-methylphenyl]sulfonyl-2-methylphenoxy]acetonitrile IUPAC Name: 2-[4-[4-(cyanomethoxy)-3-methylphenyl]sulfonyl-2-methylphenoxy]acetonitrile Traditional Name: 2-[4-[4-(cyanomethoxy)-3-methyl-phenyl]sulfonyl-2-methyl-phenoxy]acetonitrile Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C2=CC(=C(C=C2)OCC#N)C)OCC#N

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)C2=CC(=C(C=C2)OCC#N)C)OCC#N

InChI

InChI=1S/C18H16N2O4S/c1-13-11-15(3-5-17(13)23-9-7-19)25(21,22)16-4-6-18(14(2)12-16)24-10-8-20/h3-6,11-12H,9-10H2,1-2H3