1-(4-tert-butylphenyl)-5-ethyl-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(4-tert-butylphenyl)-5-ethyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(4-tert-butylphenyl)-5-ethyl-triazole-4-carboxylic acid CAS Name: 1-(4-tert-butylphenyl)-5-ethyl-4-triazolecarboxylic acid IUPAC Name: 1-(4-tert-butylphenyl)-5-ethyltriazole-4-carboxylic acid Traditional Name: 1-(4-tert-butylphenyl)-5-ethyl-triazole-4-carboxylic acid Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=NN1C2=CC=C(C=C2)C(C)(C)C)C(=O)O

Isomeric SMILES

CCC1=C(N=NN1C2=CC=C(C=C2)C(C)(C)C)C(=O)O

InChI

InChI=1S/C15H19N3O2/c1-5-12-13(14(19)20)16-17-18(12)11-8-6-10(7-9-11)15(2,3)4/h6-9H,5H2,1-4H3,(H,19,20)