dimethyl 5-[2-(4-piperidin-1-ylsulfonylphenoxy)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(4-piperidin-1-ylsulfonylphenoxy)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[4-(1-piperidylsulfonyl)phenoxy]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-[4-(1-piperidinylsulfonyl)phenoxy]ethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(4-piperidin-1-ylsulfonylphenoxy)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(4-piperidinosulfonylphenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C23H26N2O8S MolecularWeight: 490.52614

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)COC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)OC

InChI

InChI=1S/C23H26N2O8S/c1-31-22(27)16-12-17(23(28)32-2)14-18(13-16)24-21(26)15-33-19-6-8-20(9-7-19)34(29,30)25-10-4-3-5-11-25/h6-9,12-14H,3-5,10-11,15H2,1-2H3,(H,24,26)