ethyl 5-(4-methoxyphenyl)-2-(5-methyl-2-nitro-phenyl)-1,2,4-triazole-3-carboxylate

Systemtic Name: ethyl 5-(4-methoxyphenyl)-2-(5-methyl-2-nitro-phenyl)-1,2,4-triazole-3-carboxylate Openeye Name: ethyl 5-(4-methoxyphenyl)-2-(5-methyl-2-nitro-phenyl)-1,2,4-triazole-3-carboxylate CAS Name: 5-(4-methoxyphenyl)-2-(5-methyl-2-nitrophenyl)-1,2,4-triazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-methoxyphenyl)-2-(5-methyl-2-nitrophenyl)-1,2,4-triazole-3-carboxylate Traditional Name: 5-(4-methoxyphenyl)-2-(5-methyl-2-nitro-phenyl)-1,2,4-triazole-3-carboxylic acid ethyl ester Formula: C19H18N4O5 MolecularWeight: 382.37002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=NN1C2=C(C=CC(=C2)C)[N+](=O)[O-])C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=NC(=NN1C2=C(C=CC(=C2)C)[N+](=O)[O-])C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H18N4O5/c1-4-28-19(24)18-20-17(13-6-8-14(27-3)9-7-13)21-22(18)16-11-12(2)5-10-15(16)23(25)26/h5-11H,4H2,1-3H3