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

Systemtic Name: ethyl 4-(2-methyl-5-morpholin-4-ylsulfonyl-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(2-methyl-5-morpholinosulfonyl-benzoyl)piperazine-1-carboxylate CAS Name: 4-[[2-methyl-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methyl-5-morpholin-4-ylsulfonylbenzoyl)piperazine-1-carboxylate Traditional Name: 4-(2-methyl-5-morpholinosulfonyl-benzoyl)piperazine-1-carboxylic acid ethyl ester Formula: C19H27N3O6S MolecularWeight: 425.49918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)C

InChI

InChI=1S/C19H27N3O6S/c1-3-28-19(24)21-8-6-20(7-9-21)18(23)17-14-16(5-4-15(17)2)29(25,26)22-10-12-27-13-11-22/h4-5,14H,3,6-13H2,1-2H3