dimethyl 2-[[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[1-(4-chlorophenyl)sulfonylpiperidine-4-carbonyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[[1-(4-chlorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[1-(4-chlorophenyl)sulfonylpiperidine-4-carbonyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[1-(4-chlorophenyl)sulfonylisonipecotoyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C22H23ClN2O7S MolecularWeight: 494.94522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN2O7S/c1-31-21(27)15-3-8-18(22(28)32-2)19(13-15)24-20(26)14-9-11-25(12-10-14)33(29,30)17-6-4-16(23)5-7-17/h3-8,13-14H,9-12H2,1-2H3,(H,24,26)