propan-2-yl 4-[4-[(2-fluoranyl-4-methylsulfonyl-phenoxy)methyl]-1,2,3-triazol-2-yl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[4-[(2-fluoranyl-4-methylsulfonyl-phenoxy)methyl]-1,2,3-triazol-2-yl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[4-[(2-fluoro-4-methylsulfonyl-phenoxy)methyl]triazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2-fluoro-4-methylsulfonylphenoxy)methyl]-2-triazolyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[4-[(2-fluoro-4-methylsulfonylphenoxy)methyl]triazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(2-fluoro-4-mesyl-phenoxy)methyl]triazol-2-yl]piperidine-1-carboxylic acid isopropyl ester Formula: C19H25FN4O5S MolecularWeight: 440.489003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)N2N=CC(=N2)COC3=C(C=C(C=C3)S(=O)(=O)C)F

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)N2N=CC(=N2)COC3=C(C=C(C=C3)S(=O)(=O)C)F

InChI

InChI=1S/C19H25FN4O5S/c1-13(2)29-19(25)23-8-6-15(7-9-23)24-21-11-14(22-24)12-28-18-5-4-16(10-17(18)20)30(3,26)27/h4-5,10-11,13,15H,6-9,12H2,1-3H3