(phenylmethyl) 5-fluoranyl-1-methylsulfonyl-spiro[2H-indole-3,4'-piperidine]-1'-carboxylate

Systemtic Name: (phenylmethyl) 5-fluoranyl-1-methylsulfonyl-spiro[2H-indole-3,4'-piperidine]-1'-carboxylate Openeye Name: benzyl 5-fluoro-1-methylsulfonyl-spiro[indoline-3,4'-piperidine]-1'-carboxylate CAS Name: 5-fluoro-1-methylsulfonyl-1'-spiro[2H-indole-3,4'-piperidine]carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-fluoro-1-methylsulfonylspiro[2H-indole-3,4'-piperidine]-1'-carboxylate Traditional Name: 5-fluoro-1-mesyl-spiro[indoline-3,4'-piperidine]-1'-carboxylic acid benzyl ester Formula: C21H23FN2O4S MolecularWeight: 418.481723

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2(CCN(CC2)C(=O)OCC3=CC=CC=C3)C4=C1C=CC(=C4)F

Isomeric SMILES

CS(=O)(=O)N1CC2(CCN(CC2)C(=O)OCC3=CC=CC=C3)C4=C1C=CC(=C4)F

InChI

InChI=1S/C21H23FN2O4S/c1-29(26,27)24-15-21(18-13-17(22)7-8-19(18)24)9-11-23(12-10-21)20(25)28-14-16-5-3-2-4-6-16/h2-8,13H,9-12,14-15H2,1H3