ethyl 1-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(2-methyl-5-morpholinosulfonyl-benzoyl)piperidine-4-carboxylate CAS Name: 1-[[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methyl-5-morpholin-4-ylsulfonylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-(2-methyl-5-morpholinosulfonyl-benzoyl)isonipecotic acid ethyl ester Formula: C20H28N2O6S MolecularWeight: 424.51112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C20H28N2O6S/c1-3-28-20(24)16-6-8-21(9-7-16)19(23)18-14-17(5-4-15(18)2)29(25,26)22-10-12-27-13-11-22/h4-5,14,16H,3,6-13H2,1-2H3