propan-2-yl 5-methyl-1-(2-methyl-4-nitro-phenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: propan-2-yl 5-methyl-1-(2-methyl-4-nitro-phenyl)-1,2,3-triazole-4-carboxylate Openeye Name: isopropyl 5-methyl-1-(2-methyl-4-nitro-phenyl)triazole-4-carboxylate CAS Name: 5-methyl-1-(2-methyl-4-nitrophenyl)-4-triazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-methyl-1-(2-methyl-4-nitrophenyl)triazole-4-carboxylate Traditional Name: 5-methyl-1-(2-methyl-4-nitro-phenyl)triazole-4-carboxylic acid isopropyl ester Formula: C14H16N4O4 MolecularWeight: 304.30124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=C(N=N2)C(=O)OC(C)C)C

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=C(N=N2)C(=O)OC(C)C)C

InChI

InChI=1S/C14H16N4O4/c1-8(2)22-14(19)13-10(4)17(16-15-13)12-6-5-11(18(20)21)7-9(12)3/h5-8H,1-4H3