4-[(Z)-(1-ethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(Z)-(1-ethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(Z)-(1-ethyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(Z)-(1-ethyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(Z)-(1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(Z)-(1-ethyl-5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]-2-methoxy-6-nitro-phenolate Formula: C13H12N3O5S- MolecularWeight: 322.31648

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-])NC1=S

Isomeric SMILES

CCN1C(=O)/C(=C/C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-])/NC1=S

InChI

InChI=1S/C13H13N3O5S/c1-3-15-12(18)8(14-13(15)22)4-7-5-9(16(19)20)11(17)10(6-7)21-2/h4-6,17H,3H2,1-2H3,(H,14,22)/p-1/b8-4-