ethyl 4-[2-[(phenylmethyl)sulfonylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(phenylmethyl)sulfonylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(benzylsulfonylamino)benzoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[2-[(phenylmethyl)sulfonylamino]phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(benzylsulfonylamino)benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-(benzylsulfonylamino)benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H25N3O5S MolecularWeight: 431.5053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2NS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O5S/c1-2-29-21(26)24-14-12-23(13-15-24)20(25)18-10-6-7-11-19(18)22-30(27,28)16-17-8-4-3-5-9-17/h3-11,22H,2,12-16H2,1H3