4-cyclohexylsulfonyloxy-1-(phenylcarbonyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 4-cyclohexylsulfonyloxy-1-(phenylcarbonyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-benzoyl-4-cyclohexylsulfonyloxy-pyrrolidine-2-carboxylic acid CAS Name: 1-benzoyl-4-cyclohexylsulfonyloxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-benzoyl-4-cyclohexylsulfonyloxypyrrolidine-2-carboxylic acid Traditional Name: 1-benzoyl-4-cyclohexylsulfonyloxy-proline Formula: C18H23NO6S MolecularWeight: 381.44332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)S(=O)(=O)OC2CC(N(C2)C(=O)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CCC(CC1)S(=O)(=O)OC2CC(N(C2)C(=O)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H23NO6S/c20-17(13-7-3-1-4-8-13)19-12-14(11-16(19)18(21)22)25-26(23,24)15-9-5-2-6-10-15/h1,3-4,7-8,14-16H,2,5-6,9-12H2,(H,21,22)