dimethyl 2-[(2-nitrophenyl)-nitroso-methylidene]-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-[(2-nitrophenyl)-nitroso-methylidene]-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-[(2-nitrophenyl)-nitroso-methylene]-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[(2-nitrophenyl)-nitrosomethylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-nitrophenyl)-nitrosomethylidene]-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-[(2-nitrophenyl)-nitroso-methylene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C14H10N2O7S2 MolecularWeight: 382.3684

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C(C2=CC=CC=C2[N+](=O)[O-])N=O)S1)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC(=C(C2=CC=CC=C2[N+](=O)[O-])N=O)S1)C(=O)OC

InChI

InChI=1S/C14H10N2O7S2/c1-22-12(17)10-11(13(18)23-2)25-14(24-10)9(15-19)7-5-3-4-6-8(7)16(20)21/h3-6H,1-2H3