methyl 1-[2-[(3-chlorophenyl)-methylsulfonyl-amino]propanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(3-chlorophenyl)-methylsulfonyl-amino]propanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(3-chloro-N-methylsulfonyl-anilino)propanoyl]piperidine-4-carboxylate CAS Name: 1-[2-(3-chloro-N-methylsulfonylanilino)-1-oxopropyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3-chloro-N-methylsulfonylanilino)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-chloro-N-mesyl-anilino)propanoyl]isonipecotic acid methyl ester Formula: C17H23ClN2O5S MolecularWeight: 402.89292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(=O)OC)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)N1CCC(CC1)C(=O)OC)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C17H23ClN2O5S/c1-12(16(21)19-9-7-13(8-10-19)17(22)25-2)20(26(3,23)24)15-6-4-5-14(18)11-15/h4-6,11-13H,7-10H2,1-3H3