1-[2-(butylsulfonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(butylsulfonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(butylsulfonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-(butylsulfonylamino)-1-oxo-3-phenylpropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(butylsulfonylamino)-3-phenylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(butylsulfonylamino)-3-phenyl-propanoyl]proline Formula: C18H26N2O5S MolecularWeight: 382.47444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(CC1=CC=CC=C1)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CCCCS(=O)(=O)NC(CC1=CC=CC=C1)C(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C18H26N2O5S/c1-2-3-12-26(24,25)19-15(13-14-8-5-4-6-9-14)17(21)20-11-7-10-16(20)18(22)23/h4-6,8-9,15-16,19H,2-3,7,10-13H2,1H3,(H,22,23)