tert-butyl 2-(4-phenylphenoxy)-2-(1,2,4-triazol-1-yl)ethanoate

Systemtic Name: tert-butyl 2-(4-phenylphenoxy)-2-(1,2,4-triazol-1-yl)ethanoate Openeye Name: tert-butyl 2-(4-phenylphenoxy)-2-(1,2,4-triazol-1-yl)acetate CAS Name: 2-(4-phenylphenoxy)-2-(1,2,4-triazol-1-yl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-phenylphenoxy)-2-(1,2,4-triazol-1-yl)acetate Traditional Name: 2-(4-phenylphenoxy)-2-(1,2,4-triazol-1-yl)acetic acid tert-butyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C(N1C=NC=N1)OC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O3/c1-20(2,3)26-19(24)18(23-14-21-13-22-23)25-17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-14,18H,1-3H3