dimethyl 5-[[1-(4-methylpiperidin-1-yl)sulfonylpiperidin-3-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[1-(4-methylpiperidin-1-yl)sulfonylpiperidin-3-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[1-[(4-methyl-1-piperidyl)sulfonyl]piperidine-3-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[1-[(4-methyl-1-piperidinyl)sulfonyl]-3-piperidinyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[1-(4-methylpiperidin-1-yl)sulfonylpiperidine-3-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[1-(4-methylpiperidino)sulfonylnipecotoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H31N3O7S MolecularWeight: 481.56244

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H31N3O7S/c1-15-6-9-24(10-7-15)33(29,30)25-8-4-5-16(14-25)20(26)23-19-12-17(21(27)31-2)11-18(13-19)22(28)32-3/h11-13,15-16H,4-10,14H2,1-3H3,(H,23,26)