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

Systemtic Name: cyclohexyl 1-(4-butylphenyl)-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: cyclohexyl 1-(4-butylphenyl)-5-methyl-triazole-4-carboxylate CAS Name: 1-(4-butylphenyl)-5-methyl-4-triazolecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 1-(4-butylphenyl)-5-methyltriazole-4-carboxylate Traditional Name: 1-(4-butylphenyl)-5-methyl-triazole-4-carboxylic acid cyclohexyl ester Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)OC3CCCCC3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)OC3CCCCC3)C

InChI

InChI=1S/C20H27N3O2/c1-3-4-8-16-11-13-17(14-12-16)23-15(2)19(21-22-23)20(24)25-18-9-6-5-7-10-18/h11-14,18H,3-10H2,1-2H3