ethyl 1-(4-methoxy-2-nitro-phenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-(4-methoxy-2-nitro-phenyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(4-methoxy-2-nitro-phenyl)triazole-4-carboxylate CAS Name: 1-(4-methoxy-2-nitrophenyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methoxy-2-nitrophenyl)triazole-4-carboxylate Traditional Name: 1-(4-methoxy-2-nitro-phenyl)triazole-4-carboxylic acid ethyl ester Formula: C12H12N4O5 MolecularWeight: 292.24748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=N1)C2=C(C=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CN(N=N1)C2=C(C=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O5/c1-3-21-12(17)9-7-15(14-13-9)10-5-4-8(20-2)6-11(10)16(18)19/h4-7H,3H2,1-2H3