(2E)-4-chloranyl-5-diethoxyphosphoryl-2-[(4-nitrophenyl)methylidene]-1,3-dithiole

Systemtic Name: (2E)-4-chloranyl-5-diethoxyphosphoryl-2-[(4-nitrophenyl)methylidene]-1,3-dithiole Openeye Name: (2E)-4-chloro-5-diethoxyphosphoryl-2-[(4-nitrophenyl)methylene]-1,3-dithiole CAS Name: (2E)-4-chloro-5-diethoxyphosphoryl-2-[(4-nitrophenyl)methylidene]-1,3-dithiole IUPAC Name: (2E)-4-chloro-5-diethoxyphosphoryl-2-[(4-nitrophenyl)methylidene]-1,3-dithiole Traditional Name: (2E)-4-chloro-5-diethoxyphosphoryl-2-(4-nitrobenzylidene)-1,3-dithiole Formula: C14H15ClNO5PS2 MolecularWeight: 407.829361

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(SC(=CC2=CC=C(C=C2)[N+](=O)[O-])S1)Cl)OCC

Isomeric SMILES

CCOP(=O)(C1=C(S/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/S1)Cl)OCC

InChI

InChI=1S/C14H15ClNO5PS2/c1-3-20-22(19,21-4-2)14-13(15)23-12(24-14)9-10-5-7-11(8-6-10)16(17)18/h5-9H,3-4H2,1-2H3/b12-9-