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

Systemtic Name: 2-ethoxy-6-[(Z)-[1-(4-ethoxyphenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]methyl]-4-nitro-phenolate Openeye Name: 2-ethoxy-6-[(Z)-[1-(4-ethoxyphenyl)-5-oxo-2-thioxo-imidazolidin-4-ylidene]methyl]-4-nitro-phenolate CAS Name: 2-ethoxy-6-[(Z)-[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylidene-4-imidazolidinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-ethoxy-6-[(Z)-[1-(4-ethoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl]-4-nitrophenolate Traditional Name: 2-ethoxy-6-[(Z)-(5-keto-1-p-phenetyl-2-thioxo-imidazolidin-4-ylidene)methyl]-4-nitro-phenolate Formula: C20H18N3O6S- MolecularWeight: 428.43842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=CC(=C3[O-])OCC)[N+](=O)[O-])NC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC(=CC(=C3[O-])OCC)[N+](=O)[O-])/NC2=S

InChI

InChI=1S/C20H19N3O6S/c1-3-28-15-7-5-13(6-8-15)22-19(25)16(21-20(22)30)10-12-9-14(23(26)27)11-17(18(12)24)29-4-2/h5-11,24H,3-4H2,1-2H3,(H,21,30)/p-1/b16-10-