dimethyl 5-[(1-thiophen-2-ylcarbonylpiperidin-2-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(1-thiophen-2-ylcarbonylpiperidin-2-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[1-(thiophene-2-carbonyl)piperidine-2-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-[1-[oxo(thiophen-2-yl)methyl]-2-piperidinyl]methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[1-(thiophene-2-carbonyl)piperidine-2-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[1-(2-thenoyl)pipecoloyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2CCCCN2C(=O)C3=CC=CS3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2CCCCN2C(=O)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C21H22N2O6S/c1-28-20(26)13-10-14(21(27)29-2)12-15(11-13)22-18(24)16-6-3-4-8-23(16)19(25)17-7-5-9-30-17/h5,7,9-12,16H,3-4,6,8H2,1-2H3,(H,22,24)