[5-cyano-3-diethoxyphosphoryl-6-(4-fluorophenyl)-4-methylsulfanyl-pyran-2-ylidene]azanium

Systemtic Name: [5-cyano-3-diethoxyphosphoryl-6-(4-fluorophenyl)-4-methylsulfanyl-pyran-2-ylidene]azanium Openeye Name: [5-cyano-3-diethoxyphosphoryl-6-(4-fluorophenyl)-4-methylsulfanyl-pyran-2-ylidene]ammonium CAS Name: [5-cyano-3-diethoxyphosphoryl-6-(4-fluorophenyl)-4-(methylthio)-2-pyranylidene]ammonium IUPAC Name: [5-cyano-3-diethoxyphosphoryl-6-(4-fluorophenyl)-4-methylsulfanylpyran-2-ylidene]azanium Traditional Name: [5-cyano-3-diethoxyphosphoryl-6-(4-fluorophenyl)-4-(methylthio)pyran-2-ylidene]ammonium Formula: C17H19FN2O4PS+ MolecularWeight: 397.380924

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(C(=C(OC1=[NH2+])C2=CC=C(C=C2)F)C#N)SC)OCC

Isomeric SMILES

CCOP(=O)(C1=C(C(=C(OC1=[NH2+])C2=CC=C(C=C2)F)C#N)SC)OCC

InChI

InChI=1S/C17H18FN2O4PS/c1-4-22-25(21,23-5-2)15-16(26-3)13(10-19)14(24-17(15)20)11-6-8-12(18)9-7-11/h6-9,20H,4-5H2,1-3H3/p+1