4-bromanyl-2-[(E)-[2-[(4-ethoxyphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]-6-nitro-phenolate

Systemtic Name: 4-bromanyl-2-[(E)-[2-[(4-ethoxyphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]-6-nitro-phenolate Openeye Name: 4-bromo-2-[(E)-[2-(4-ethoxyanilino)-4-oxo-thiazol-5-ylidene]methyl]-6-nitro-phenolate CAS Name: 4-bromo-2-[(E)-[2-(4-ethoxyanilino)-4-oxo-5-thiazolylidene]methyl]-6-nitrophenolate IUPAC Name: 4-bromo-2-[(E)-[2-(4-ethoxyanilino)-4-oxo-1,3-thiazol-5-ylidene]methyl]-6-nitrophenolate Traditional Name: 4-bromo-2-[(E)-[4-keto-2-(p-phenetidino)-2-thiazolin-5-ylidene]methyl]-6-nitro-phenolate Formula: C18H13BrN3O5S- MolecularWeight: 463.28192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br)S2

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=O)/C(=C\C3=CC(=CC(=C3[O-])[N+](=O)[O-])Br)/S2

InChI

InChI=1S/C18H14BrN3O5S/c1-2-27-13-5-3-12(4-6-13)20-18-21-17(24)15(28-18)8-10-7-11(19)9-14(16(10)23)22(25)26/h3-9,23H,2H2,1H3,(H,20,21,24)/p-1/b15-8+