[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 1-(phenylsulfonyl)piperidine-4-carboxylate

Systemtic Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 1-(phenylsulfonyl)piperidine-4-carboxylate Openeye Name: (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl 1-(benzenesulfonyl)piperidine-4-carboxylate CAS Name: 1-(benzenesulfonyl)-4-piperidinecarboxylic acid [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 1-(benzenesulfonyl)piperidine-4-carboxylate Traditional Name: 1-besylisonipecotic acid (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)COC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H25N3O5S/c1-14(2)12-17-20-18(27-21-17)13-26-19(23)15-8-10-22(11-9-15)28(24,25)16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3