2-nitro-6-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenolate

Systemtic Name: 2-nitro-6-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenolate Openeye Name: 2-[(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate CAS Name: 2-nitro-6-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-5-thiazolidinylidene)methyl]phenolate IUPAC Name: 2-nitro-6-[(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenolate Traditional Name: 2-[(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate Formula: C13H9N2O4S2- MolecularWeight: 321.35156

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=C(C(=CC=C2)[N+](=O)[O-])[O-])SC1=S

Isomeric SMILES

C=CCN1C(=O)C(=CC2=C(C(=CC=C2)[N+](=O)[O-])[O-])SC1=S

InChI

InChI=1S/C13H10N2O4S2/c1-2-6-14-12(17)10(21-13(14)20)7-8-4-3-5-9(11(8)16)15(18)19/h2-5,7,16H,1,6H2/p-1