ethyl 1-[5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoyl]piperidine-4-carboxylate CAS Name: 1-[[5-(dimethylsulfamoyl)-2-(1-pyrrolidinyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(dimethylsulfamoyl)-2-pyrrolidin-1-ylbenzoyl]piperidine-4-carboxylate Traditional Name: 1-[5-(dimethylsulfamoyl)-2-pyrrolidino-benzoyl]isonipecotic acid ethyl ester Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)N3CCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N(C)C)N3CCCC3

InChI

InChI=1S/C21H31N3O5S/c1-4-29-21(26)16-9-13-24(14-10-16)20(25)18-15-17(30(27,28)22(2)3)7-8-19(18)23-11-5-6-12-23/h7-8,15-16H,4-6,9-14H2,1-3H3