methylsulfinylbenzene; 4-oxidanylidenebutanenitrile

Systemtic Name: methylsulfinylbenzene; 4-oxidanylidenebutanenitrile Openeye Name: methylsulfinylbenzene; 4-oxobutanenitrile CAS Name: methylsulfinylbenzene; 4-oxobutanenitrile IUPAC Name: methylsulfinylbenzene; 4-oxobutanenitrile Traditional Name: 4-ketobutyronitrile; methylsulfinylbenzene Formula: C11H13NO2S MolecularWeight: 223.29142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8OS.C4H5NO/c1-9(8)7-5-3-2-4-6-7;5-3-1-2-4-6/h2-6H,1H3;4H,1-2H2