ethyl 4-[2-[3-(phenylsulfonyl)propanoylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[3-(phenylsulfonyl)propanoylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[3-(benzenesulfonyl)propanoylamino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[2-[[3-(benzenesulfonyl)-1-oxopropyl]amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-(benzenesulfonyl)propanoylamino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3-besylpropanoylamino)benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H27N3O6S MolecularWeight: 473.54198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CCS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O6S/c1-2-32-23(29)26-15-13-25(14-16-26)22(28)19-10-6-7-11-20(19)24-21(27)12-17-33(30,31)18-8-4-3-5-9-18/h3-11H,2,12-17H2,1H3,(H,24,27)