2-methoxy-6-nitro-4-[(Z)-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenolate

Systemtic Name: 2-methoxy-6-nitro-4-[(Z)-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenolate Openeye Name: 2-methoxy-6-nitro-4-[(Z)-(4-oxo-3-phenyl-2-thioxo-thiazolidin-5-ylidene)methyl]phenolate CAS Name: 2-methoxy-6-nitro-4-[(Z)-(4-oxo-3-phenyl-2-sulfanylidene-5-thiazolidinylidene)methyl]phenolate IUPAC Name: 2-methoxy-6-nitro-4-[(Z)-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenolate Traditional Name: 4-[(Z)-(4-keto-3-phenyl-2-thioxo-thiazolidin-5-ylidene)methyl]-2-methoxy-6-nitro-phenolate Formula: C17H11N2O5S2- MolecularWeight: 387.40964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2C(=O)N(C(=S)S2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])/C=C\2/C(=O)N(C(=S)S2)C3=CC=CC=C3

InChI

InChI=1S/C17H12N2O5S2/c1-24-13-8-10(7-12(15(13)20)19(22)23)9-14-16(21)18(17(25)26-14)11-5-3-2-4-6-11/h2-9,20H,1H3/p-1/b14-9-