(4-chloranylnaphthalen-1-yl) 1-(phenylsulfonyl)piperidine-4-carboxylate

Systemtic Name: (4-chloranylnaphthalen-1-yl) 1-(phenylsulfonyl)piperidine-4-carboxylate Openeye Name: (4-chloro-1-naphthyl) 1-(benzenesulfonyl)piperidine-4-carboxylate CAS Name: 1-(benzenesulfonyl)-4-piperidinecarboxylic acid (4-chloro-1-naphthalenyl) ester IUPAC Name: (4-chloronaphthalen-1-yl) 1-(benzenesulfonyl)piperidine-4-carboxylate Traditional Name: 1-besylisonipecotic acid (4-chloro-1-naphthyl) ester Formula: C22H20ClNO4S MolecularWeight: 429.9165

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=CC=C(C3=CC=CC=C32)Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)OC2=CC=C(C3=CC=CC=C32)Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20ClNO4S/c23-20-10-11-21(19-9-5-4-8-18(19)20)28-22(25)16-12-14-24(15-13-16)29(26,27)17-6-2-1-3-7-17/h1-11,16H,12-15H2