2-bromanyl-6-[(E)-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-nitro-phenolate

Systemtic Name: 2-bromanyl-6-[(E)-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-nitro-phenolate Openeye Name: 2-bromo-6-[(E)-[3-[(4-methoxyphenyl)methyl]-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]-4-nitro-phenolate CAS Name: 2-bromo-6-[(E)-[3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-bromo-6-[(E)-[3-[(4-methoxyphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-4-nitrophenolate Traditional Name: 2-bromo-6-[(E)-(4-keto-3-p-anisyl-2-thioxo-thiazolidin-5-ylidene)methyl]-4-nitro-phenolate Formula: C18H12BrN2O5S2- MolecularWeight: 480.33228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrN2O5S2/c1-26-13-4-2-10(3-5-13)9-20-17(23)15(28-18(20)27)7-11-6-12(21(24)25)8-14(19)16(11)22/h2-8,22H,9H2,1H3/p-1/b15-7+