methyl 4-(diethylamino)-5-methyl-3-(4-nitrophenyl)-4H-1,2,3-triazole-5-carboxylate

Systemtic Name: methyl 4-(diethylamino)-5-methyl-3-(4-nitrophenyl)-4H-1,2,3-triazole-5-carboxylate Openeye Name: methyl 4-(diethylamino)-5-methyl-3-(4-nitrophenyl)-4H-triazole-5-carboxylate CAS Name: 4-(diethylamino)-5-methyl-3-(4-nitrophenyl)-4H-triazole-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(diethylamino)-5-methyl-3-(4-nitrophenyl)-4H-triazole-5-carboxylate Traditional Name: 4-(diethylamino)-5-methyl-3-(4-nitrophenyl)-4H-triazole-5-carboxylic acid methyl ester Formula: C15H21N5O4 MolecularWeight: 335.35834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1C(N=NN1C2=CC=C(C=C2)[N+](=O)[O-])(C)C(=O)OC

Isomeric SMILES

CCN(CC)C1C(N=NN1C2=CC=C(C=C2)[N+](=O)[O-])(C)C(=O)OC

InChI

InChI=1S/C15H21N5O4/c1-5-18(6-2)13-15(3,14(21)24-4)16-17-19(13)11-7-9-12(10-8-11)20(22)23/h7-10,13H,5-6H2,1-4H3