methyl 1-[2-[[4-(dimethylcarbamoyl)phenyl]-methylsulfonyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[[4-(dimethylcarbamoyl)phenyl]-methylsulfonyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[4-(dimethylcarbamoyl)-N-methylsulfonyl-anilino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[4-[dimethylamino(oxo)methyl]-N-methylsulfonylanilino]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[4-(dimethylcarbamoyl)-N-methylsulfonylanilino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[4-(dimethylcarbamoyl)-N-mesyl-anilino]acetyl]isonipecotic acid methyl ester Formula: C19H27N3O6S MolecularWeight: 425.49918

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)N(CC(=O)N2CCC(CC2)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)N(CC(=O)N2CCC(CC2)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C19H27N3O6S/c1-20(2)18(24)14-5-7-16(8-6-14)22(29(4,26)27)13-17(23)21-11-9-15(10-12-21)19(25)28-3/h5-8,15H,9-13H2,1-4H3