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

Systemtic Name: dimethyl 2-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[4-(1-piperidylsulfonyl)benzoyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(4-piperidin-1-ylsulfonylbenzoyl)amino]benzene-1,4-dicarboxylate Traditional Name: 2-[(4-piperidinosulfonylbenzoyl)amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C22H24N2O7S MolecularWeight: 460.50016

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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)S(=O)(=O)N3CCCCC3

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O7S/c1-30-21(26)16-8-11-18(22(27)31-2)19(14-16)23-20(25)15-6-9-17(10-7-15)32(28,29)24-12-4-3-5-13-24/h6-11,14H,3-5,12-13H2,1-2H3,(H,23,25)