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

Systemtic Name: ethyl 4-[[2-(4-methoxyphenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-ylidene]amino]benzoate Openeye Name: ethyl 4-[[3-hydroxy-2-(4-methoxyphenyl)-5-nitro-triazol-4-ylidene]amino]benzoate CAS Name: 4-[[3-hydroxy-2-(4-methoxyphenyl)-5-nitro-4-triazolylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-hydroxy-2-(4-methoxyphenyl)-5-nitrotriazol-4-ylidene]amino]benzoate Traditional Name: 4-[[3-hydroxy-2-(4-methoxyphenyl)-5-nitro-triazol-4-ylidene]amino]benzoic acid ethyl ester Formula: C18H17N5O6 MolecularWeight: 399.35748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N5O6/c1-3-29-18(24)12-4-6-13(7-5-12)19-16-17(23(26)27)20-21(22(16)25)14-8-10-15(28-2)11-9-14/h4-11,25H,3H2,1-2H3