ethyl 5-(3,4-dimethylphenoxy)-1-(phenylmethyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-(3,4-dimethylphenoxy)-1-(phenylmethyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-benzyl-5-(3,4-dimethylphenoxy)triazole-4-carboxylate CAS Name: 5-(3,4-dimethylphenoxy)-1-(phenylmethyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-(3,4-dimethylphenoxy)triazole-4-carboxylate Traditional Name: 1-benzyl-5-(3,4-dimethylphenoxy)triazole-4-carboxylic acid ethyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)CC2=CC=CC=C2)OC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)CC2=CC=CC=C2)OC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C20H21N3O3/c1-4-25-20(24)18-19(26-17-11-10-14(2)15(3)12-17)23(22-21-18)13-16-8-6-5-7-9-16/h5-12H,4,13H2,1-3H3