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

Systemtic Name: ethyl 5-methyl-1-(3-nitrophenyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-(3-nitrophenyl)triazole-4-carboxylate CAS Name: 5-methyl-1-(3-nitrophenyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-(3-nitrophenyl)triazole-4-carboxylate Traditional Name: 5-methyl-1-(3-nitrophenyl)triazole-4-carboxylic acid ethyl ester Formula: C12H12N4O4 MolecularWeight: 276.24808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N4O4/c1-3-20-12(17)11-8(2)15(14-13-11)9-5-4-6-10(7-9)16(18)19/h4-7H,3H2,1-2H3