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

Systemtic Name: 2-[(Z)-(3-butyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate Openeye Name: 2-[(Z)-(3-butyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate CAS Name: 2-[(Z)-(3-butyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-6-nitrophenolate IUPAC Name: 2-[(Z)-(3-butyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-6-nitrophenolate Traditional Name: 2-[(Z)-(3-butyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-6-nitro-phenolate Formula: C14H13N2O4S2- MolecularWeight: 337.39402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=C(C(=CC=C2)[N+](=O)[O-])[O-])SC1=S

Isomeric SMILES

CCCCN1C(=O)/C(=C/C2=C(C(=CC=C2)[N+](=O)[O-])[O-])/SC1=S

InChI

InChI=1S/C14H14N2O4S2/c1-2-3-7-15-13(18)11(22-14(15)21)8-9-5-4-6-10(12(9)17)16(19)20/h4-6,8,17H,2-3,7H2,1H3/p-1/b11-8-