2-(4-tert-butylsulfonylphenoxy)-6-methyl-benzenecarbonitrile

Systemtic Name: 2-(4-tert-butylsulfonylphenoxy)-6-methyl-benzenecarbonitrile Openeye Name: 2-(4-tert-butylsulfonylphenoxy)-6-methyl-benzonitrile CAS Name: 2-(4-tert-butylsulfonylphenoxy)-6-methylbenzonitrile IUPAC Name: 2-(4-tert-butylsulfonylphenoxy)-6-methylbenzonitrile Traditional Name: 2-(4-tert-butylsulfonylphenoxy)-6-methyl-benzonitrile Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC2=CC=C(C=C2)S(=O)(=O)C(C)(C)C)C#N

Isomeric SMILES

CC1=C(C(=CC=C1)OC2=CC=C(C=C2)S(=O)(=O)C(C)(C)C)C#N

InChI

InChI=1S/C18H19NO3S/c1-13-6-5-7-17(16(13)12-19)22-14-8-10-15(11-9-14)23(20,21)18(2,3)4/h5-11H,1-4H3