5-[[(E)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]-2-oxidanyl-benzoate

Systemtic Name: 5-[[(E)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]-2-oxidanyl-benzoate Openeye Name: 5-[[(E)-2-cyano-2-[4-(4-nitrophenyl)thiazol-2-yl]vinyl]amino]-2-hydroxy-benzoate CAS Name: 5-[[(E)-2-cyano-2-[4-(4-nitrophenyl)-2-thiazolyl]ethenyl]amino]-2-hydroxybenzoate IUPAC Name: 5-[[(E)-2-cyano-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]-2-hydroxybenzoate Traditional Name: 5-[[(E)-2-cyano-2-[4-(4-nitrophenyl)thiazol-2-yl]vinyl]amino]-2-hydroxy-benzoate Formula: C19H11N4O5S- MolecularWeight: 407.37944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC(=N2)C(=CNC3=CC(=C(C=C3)O)C(=O)[O-])C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CSC(=N2)/C(=C/NC3=CC(=C(C=C3)O)C(=O)[O-])/C#N)[N+](=O)[O-]

InChI

InChI=1S/C19H12N4O5S/c20-8-12(9-21-13-3-6-17(24)15(7-13)19(25)26)18-22-16(10-29-18)11-1-4-14(5-2-11)23(27)28/h1-7,9-10,21,24H,(H,25,26)/p-1/b12-9+