4-[[methoxy(methylsulfanyl)phosphoryl]oxymethyl]benzenecarbonitrile

Systemtic Name: 4-[[methoxy(methylsulfanyl)phosphoryl]oxymethyl]benzenecarbonitrile Openeye Name: 4-[[methoxy(methylsulfanyl)phosphoryl]oxymethyl]benzonitrile CAS Name: 4-[[methoxy-(methylthio)phosphoryl]oxymethyl]benzonitrile IUPAC Name: 4-[[methoxy(methylsulfanyl)phosphoryl]oxymethyl]benzonitrile Traditional Name: 4-[[methoxy-(methylthio)phosphoryl]oxymethyl]benzonitrile Formula: C10H12NO3PS MolecularWeight: 257.245941

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(OCC1=CC=C(C=C1)C#N)SC

Isomeric SMILES

COP(=O)(OCC1=CC=C(C=C1)C#N)SC

InChI

InChI=1S/C10H12NO3PS/c1-13-15(12,16-2)14-8-10-5-3-9(7-11)4-6-10/h3-6H,8H2,1-2H3