ethyl 4-[[2-(4-chlorophenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-ylidene]amino]benzoate

Systemtic Name: ethyl 4-[[2-(4-chlorophenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-ylidene]amino]benzoate Openeye Name: ethyl 4-[[2-(4-chlorophenyl)-3-hydroxy-5-nitro-triazol-4-ylidene]amino]benzoate CAS Name: 4-[[2-(4-chlorophenyl)-3-hydroxy-5-nitro-4-triazolylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-chlorophenyl)-3-hydroxy-5-nitrotriazol-4-ylidene]amino]benzoate Traditional Name: 4-[[2-(4-chlorophenyl)-3-hydroxy-5-nitro-triazol-4-ylidene]amino]benzoic acid ethyl ester Formula: C17H14ClN5O5 MolecularWeight: 403.77656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2C(=NN(N2O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2C(=NN(N2O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN5O5/c1-2-28-17(24)11-3-7-13(8-4-11)19-15-16(23(26)27)20-21(22(15)25)14-9-5-12(18)6-10-14/h3-10,25H,2H2,1H3