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

Systemtic Name: 4-[(E)-[2-[(4-ethylphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(E)-[2-(4-ethylanilino)-4-oxo-thiazol-5-ylidene]methyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(E)-[2-(4-ethylanilino)-4-oxo-5-thiazolylidene]methyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(E)-[2-(4-ethylanilino)-4-oxo-1,3-thiazol-5-ylidene]methyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(E)-[2-(4-ethylanilino)-4-keto-2-thiazolin-5-ylidene]methyl]-2-methoxy-6-nitro-phenolate Formula: C19H16N3O5S- MolecularWeight: 398.41244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=C(C(=C3)OC)[O-])[N+](=O)[O-])S2

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC(=O)/C(=C\C3=CC(=C(C(=C3)OC)[O-])[N+](=O)[O-])/S2

InChI

InChI=1S/C19H17N3O5S/c1-3-11-4-6-13(7-5-11)20-19-21-18(24)16(28-19)10-12-8-14(22(25)26)17(23)15(9-12)27-2/h4-10,23H,3H2,1-2H3,(H,20,21,24)/p-1/b16-10+