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

Systemtic Name: cyclohexyl 5-methyl-1-(2-methyl-4-nitro-phenyl)-1,2,3-triazole-4-carboxylate Openeye Name: cyclohexyl 5-methyl-1-(2-methyl-4-nitro-phenyl)triazole-4-carboxylate CAS Name: 5-methyl-1-(2-methyl-4-nitrophenyl)-4-triazolecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 5-methyl-1-(2-methyl-4-nitrophenyl)triazole-4-carboxylate Traditional Name: 5-methyl-1-(2-methyl-4-nitro-phenyl)triazole-4-carboxylic acid cyclohexyl ester Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=C(N=N2)C(=O)OC3CCCCC3)C

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=C(N=N2)C(=O)OC3CCCCC3)C

InChI

InChI=1S/C17H20N4O4/c1-11-10-13(21(23)24)8-9-15(11)20-12(2)16(18-19-20)17(22)25-14-6-4-3-5-7-14/h8-10,14H,3-7H2,1-2H3