(3-chlorophenyl) 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]piperidine-4-carboxylate

Systemtic Name: (3-chlorophenyl) 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]piperidine-4-carboxylate Openeye Name: (3-chlorophenyl) 1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-4-carboxylate CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-4-piperidinecarboxylic acid (3-chlorophenyl) ester IUPAC Name: (3-chlorophenyl) 1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-4-carboxylate Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)isonipecotic acid (3-chlorophenyl) ester Formula: C19H17ClN2O4S MolecularWeight: 404.86728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC2=CC(=CC=C2)Cl)C3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

C1CN(CCC1C(=O)OC2=CC(=CC=C2)Cl)C3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C19H17ClN2O4S/c20-14-4-3-5-15(12-14)26-19(23)13-8-10-22(11-9-13)18-16-6-1-2-7-17(16)27(24,25)21-18/h1-7,12-13H,8-11H2