(4-methoxycarbonylphenyl) 1-[2,5-bis(chloranyl)phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl) 1-[2,5-bis(chloranyl)phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: (4-methoxycarbonylphenyl) 1-(2,5-dichlorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,5-dichlorophenyl)sulfonyl-4-piperidinecarboxylic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 1-(2,5-dichlorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2,5-dichlorophenyl)sulfonylisonipecotic acid (4-carbomethoxyphenyl) ester Formula: C20H19Cl2NO6S MolecularWeight: 472.33896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C20H19Cl2NO6S/c1-28-19(24)13-2-5-16(6-3-13)29-20(25)14-8-10-23(11-9-14)30(26,27)18-12-15(21)4-7-17(18)22/h2-7,12,14H,8-11H2,1H3