methyl 1-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]propanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]propanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)propanoyl]piperidine-4-carboxylate CAS Name: 1-[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-1-oxopropyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-chloro-N-mesyl-4-methoxy-anilino)propanoyl]isonipecotic acid methyl ester Formula: C18H25ClN2O6S MolecularWeight: 432.9189

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25ClN2O6S/c1-12(17(22)20-9-7-13(8-10-20)18(23)27-3)21(28(4,24)25)14-5-6-16(26-2)15(19)11-14/h5-6,11-13H,7-10H2,1-4H3