ethyl 1-[2-[(4-methylphenyl)-methylsulfonyl-amino]butanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(4-methylphenyl)-methylsulfonyl-amino]butanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-methyl-N-methylsulfonyl-anilino)butanoyl]piperidine-4-carboxylate CAS Name: 1-[2-(4-methyl-N-methylsulfonylanilino)-1-oxobutyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-methyl-N-methylsulfonylanilino)butanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(N-mesyl-4-methyl-anilino)butanoyl]isonipecotic acid ethyl ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCC(CC1)C(=O)OCC)N(C2=CC=C(C=C2)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)N1CCC(CC1)C(=O)OCC)N(C2=CC=C(C=C2)C)S(=O)(=O)C

InChI

InChI=1S/C20H30N2O5S/c1-5-18(22(28(4,25)26)17-9-7-15(3)8-10-17)19(23)21-13-11-16(12-14-21)20(24)27-6-2/h7-10,16,18H,5-6,11-14H2,1-4H3