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

Systemtic Name: ethyl 1-(phenylmethyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-benzyltriazole-4-carboxylate CAS Name: 1-(phenylmethyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyltriazole-4-carboxylate Traditional Name: 1-benzyltriazole-4-carboxylic acid ethyl ester Formula: C12H13N3O2 MolecularWeight: 231.25052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=N1)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CN(N=N1)CC2=CC=CC=C2

InChI

InChI=1S/C12H13N3O2/c1-2-17-12(16)11-9-15(14-13-11)8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3