4-[(E)-[(2Z)-2-(cyanomethylidene)-3-methyl-4-oxidanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-nitro-phenolate

Systemtic Name: 4-[(E)-[(2Z)-2-(cyanomethylidene)-3-methyl-4-oxidanylidene-1,3-thiazolidin-5-ylidene]methyl]-2-nitro-phenolate Openeye Name: 4-[(E)-[(2Z)-2-(cyanomethylene)-3-methyl-4-oxo-thiazolidin-5-ylidene]methyl]-2-nitro-phenolate CAS Name: 4-[(E)-[(2Z)-2-(cyanomethylidene)-3-methyl-4-oxo-5-thiazolidinylidene]methyl]-2-nitrophenolate IUPAC Name: 4-[(E)-[(2Z)-2-(cyanomethylidene)-3-methyl-4-oxo-1,3-thiazolidin-5-ylidene]methyl]-2-nitrophenolate Traditional Name: 4-[(E)-[(2Z)-2-(cyanomethylene)-4-keto-3-methyl-thiazolidin-5-ylidene]methyl]-2-nitro-phenolate Formula: C13H8N3O4S- MolecularWeight: 302.28532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC#N)SC(=CC2=CC(=C(C=C2)[O-])[N+](=O)[O-])C1=O

Isomeric SMILES

CN1/C(=C/C#N)/S/C(=C/C2=CC(=C(C=C2)[O-])[N+](=O)[O-])/C1=O

InChI

InChI=1S/C13H9N3O4S/c1-15-12(4-5-14)21-11(13(15)18)7-8-2-3-10(17)9(6-8)16(19)20/h2-4,6-7,17H,1H3/p-1/b11-7+,12-4-