4-[3-(4-methylphenyl)sulfonyl-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-(4-methylphenyl)sulfonyl-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 4-[2-hydroxy-3-(p-tolylsulfonyl)propoxy]benzonitrile CAS Name: 4-[2-hydroxy-3-(4-methylphenyl)sulfonylpropoxy]benzonitrile IUPAC Name: 4-[2-hydroxy-3-(4-methylphenyl)sulfonylpropoxy]benzonitrile Traditional Name: 4-(2-hydroxy-3-tosyl-propoxy)benzonitrile Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(COC2=CC=C(C=C2)C#N)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(COC2=CC=C(C=C2)C#N)O

InChI

InChI=1S/C17H17NO4S/c1-13-2-8-17(9-3-13)23(20,21)12-15(19)11-22-16-6-4-14(10-18)5-7-16/h2-9,15,19H,11-12H2,1H3