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

Systemtic Name: 2-[(Z)-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-nitro-phenolate Openeye Name: 2-[(Z)-[3-[(4-methoxyphenyl)methyl]-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-4-nitro-phenolate CAS Name: 2-[(Z)-[3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[(Z)-[3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-nitrophenolate Traditional Name: 2-[(Z)-(4-keto-3-p-anisyl-2-thioxo-thiazolidin-5-ylidene)methyl]-4-nitro-phenolate Formula: C18H13N2O5S2- MolecularWeight: 401.43622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])SC2=S

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)/C(=C/C3=C(C=CC(=C3)[N+](=O)[O-])[O-])/SC2=S

InChI

InChI=1S/C18H14N2O5S2/c1-25-14-5-2-11(3-6-14)10-19-17(22)16(27-18(19)26)9-12-8-13(20(23)24)4-7-15(12)21/h2-9,21H,10H2,1H3/p-1/b16-9-