(3,4-dimethylphenyl) 1-[2,3-bis(chloranyl)phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: (3,4-dimethylphenyl) 1-[2,3-bis(chloranyl)phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: (3,4-dimethylphenyl) 1-(2,3-dichlorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,3-dichlorophenyl)sulfonyl-4-piperidinecarboxylic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 1-(2,3-dichlorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2,3-dichlorophenyl)sulfonylisonipecotic acid (3,4-dimethylphenyl) ester Formula: C20H21Cl2NO4S MolecularWeight: 442.35604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C(=CC=C3)Cl)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C(=CC=C3)Cl)Cl)C

InChI

InChI=1S/C20H21Cl2NO4S/c1-13-6-7-16(12-14(13)2)27-20(24)15-8-10-23(11-9-15)28(25,26)18-5-3-4-17(21)19(18)22/h3-7,12,15H,8-11H2,1-2H3