methyl 1-[(3-fluorophenyl)methyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 1-[(3-fluorophenyl)methyl]-1,2,3-triazole-4-carboxylate Openeye Name: methyl 1-[(3-fluorophenyl)methyl]triazole-4-carboxylate CAS Name: 1-[(3-fluorophenyl)methyl]-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(3-fluorophenyl)methyl]triazole-4-carboxylate Traditional Name: 1-(3-fluorobenzyl)triazole-4-carboxylic acid methyl ester Formula: C11H10FN3O2 MolecularWeight: 235.214403

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=N1)CC2=CC(=CC=C2)F

Isomeric SMILES

COC(=O)C1=CN(N=N1)CC2=CC(=CC=C2)F

InChI

InChI=1S/C11H10FN3O2/c1-17-11(16)10-7-15(14-13-10)6-8-3-2-4-9(12)5-8/h2-5,7H,6H2,1H3