3-(4-chloranylbutylsulfinylmethyl)benzenecarbonitrile

Systemtic Name: 3-(4-chloranylbutylsulfinylmethyl)benzenecarbonitrile Openeye Name: 3-(4-chlorobutylsulfinylmethyl)benzonitrile CAS Name: 3-(4-chlorobutylsulfinylmethyl)benzonitrile IUPAC Name: 3-(4-chlorobutylsulfinylmethyl)benzonitrile Traditional Name: 3-(4-chlorobutylsulfinylmethyl)benzonitrile Formula: C12H14ClNOS MolecularWeight: 255.76366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CS(=O)CCCCCl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CS(=O)CCCCCl)C#N

InChI

InChI=1S/C12H14ClNOS/c13-6-1-2-7-16(15)10-12-5-3-4-11(8-12)9-14/h3-5,8H,1-2,6-7,10H2