4-[(Z)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]-2-nitro-phenolate

Systemtic Name: 4-[(Z)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]-2-nitro-phenolate Openeye Name: 4-[(Z)-2-cyano-2-[4-(3-nitrophenyl)thiazol-2-yl]vinyl]-2-nitro-phenolate CAS Name: 4-[(Z)-2-cyano-2-[4-(3-nitrophenyl)-2-thiazolyl]ethenyl]-2-nitrophenolate IUPAC Name: 4-[(Z)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]-2-nitrophenolate Traditional Name: 4-[(Z)-2-cyano-2-[4-(3-nitrophenyl)thiazol-2-yl]vinyl]-2-nitro-phenolate Formula: C18H9N4O5S- MolecularWeight: 393.35286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)C(=CC3=CC(=C(C=C3)[O-])[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)/C(=C\C3=CC(=C(C=C3)[O-])[N+](=O)[O-])/C#N

InChI

InChI=1S/C18H10N4O5S/c19-9-13(6-11-4-5-17(23)16(7-11)22(26)27)18-20-15(10-28-18)12-2-1-3-14(8-12)21(24)25/h1-8,10,23H/p-1/b13-6-