[5-(4-tert-butylphenyl)-1-phenyl-1,2,4-triazol-3-yl] ethanoate

Systemtic Name: [5-(4-tert-butylphenyl)-1-phenyl-1,2,4-triazol-3-yl] ethanoate Openeye Name: [5-(4-tert-butylphenyl)-1-phenyl-1,2,4-triazol-3-yl] acetate CAS Name: acetic acid [5-(4-tert-butylphenyl)-1-phenyl-1,2,4-triazol-3-yl] ester IUPAC Name: [5-(4-tert-butylphenyl)-1-phenyl-1,2,4-triazol-3-yl] acetate Traditional Name: acetic acid [5-(4-tert-butylphenyl)-1-phenyl-1,2,4-triazol-3-yl] ester Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CC(=O)OC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2/c1-14(24)25-19-21-18(23(22-19)17-8-6-5-7-9-17)15-10-12-16(13-11-15)20(2,3)4/h5-13H,1-4H3