dimethyl 2-[[4-(piperidin-1-ylsulfonylmethyl)phenyl]carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[4-(piperidin-1-ylsulfonylmethyl)phenyl]carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[4-(1-piperidylsulfonylmethyl)benzoyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[oxo-[4-(1-piperidinylsulfonylmethyl)phenyl]methyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[4-(piperidin-1-ylsulfonylmethyl)benzoyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[4-(piperidinosulfonylmethyl)benzoyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C23H26N2O7S MolecularWeight: 474.52674

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)CS(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)CS(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H26N2O7S/c1-31-22(27)18-10-11-19(23(28)32-2)20(14-18)24-21(26)17-8-6-16(7-9-17)15-33(29,30)25-12-4-3-5-13-25/h6-11,14H,3-5,12-13,15H2,1-2H3,(H,24,26)