2-[4-bis(ethoxysulfanyl)phosphoryloxyiminocyclohexa-2,5-dien-1-ylidene]-2-phenyl-ethanenitrile

Systemtic Name: 2-[4-bis(ethoxysulfanyl)phosphoryloxyiminocyclohexa-2,5-dien-1-ylidene]-2-phenyl-ethanenitrile Openeye Name: 2-[4-bis(ethoxysulfanyl)phosphoryloxyiminocyclohexa-2,5-dien-1-ylidene]-2-phenyl-acetonitrile CAS Name: 3-bis(ethoxythio)phosphoryloxyimino-6-[cyano(phenyl)methylidene]cyclohexa-1,4-diene IUPAC Name: 2-[4-bis(ethoxysulfanyl)phosphoryloxyiminocyclohexa-2,5-dien-1-ylidene]-2-phenylacetonitrile Traditional Name: 2-[4-bis(ethoxythio)phosphoryloximinocyclohexa-2,5-dien-1-ylidene]-2-phenyl-acetonitrile Formula: C18H19N2O4PS2 MolecularWeight: 422.458221

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Descriptors Computed from Structure

Canonical SMILES:

CCOSP(=O)(ON=C1C=CC(=C(C#N)C2=CC=CC=C2)C=C1)SOCC

Isomeric SMILES

CCOSP(=O)(ON=C1C=CC(=C(C#N)C2=CC=CC=C2)C=C1)SOCC

InChI

InChI=1S/C18H19N2O4PS2/c1-3-22-26-25(21,27-23-4-2)24-20-17-12-10-16(11-13-17)18(14-19)15-8-6-5-7-9-15/h5-13H,3-4H2,1-2H3