ethyl 5-[(1R)-1-fluoranylethyl]-1-(phenylmethyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 5-[(1R)-1-fluoranylethyl]-1-(phenylmethyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-benzyl-5-[(1R)-1-fluoroethyl]triazole-4-carboxylate CAS Name: 5-[(1R)-1-fluoroethyl]-1-(phenylmethyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-[(1R)-1-fluoroethyl]triazole-4-carboxylate Traditional Name: 1-benzyl-5-[(1R)-1-fluoroethyl]triazole-4-carboxylic acid ethyl ester Formula: C14H16FN3O2 MolecularWeight: 277.294143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)CC2=CC=CC=C2)[C@@H](C)F

InChI

InChI=1S/C14H16FN3O2/c1-3-20-14(19)12-13(10(2)15)18(17-16-12)9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3/t10-/m1/s1