5-[(E)-pent-1-enyl]-1-(phenylcarbamoyl)-3-(phenylsulfonylamino)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-[(E)-pent-1-enyl]-1-(phenylcarbamoyl)-3-(phenylsulfonylamino)pyrrolidine-2-carboxylic acid Openeye Name: 3-(benzenesulfonamido)-5-[(E)-pent-1-enyl]-1-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[anilino(oxo)methyl]-3-(benzenesulfonamido)-5-[(E)-pent-1-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(benzenesulfonamido)-5-[(E)-pent-1-enyl]-1-(phenylcarbamoyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(benzenesulfonamido)-5-[(E)-pent-1-enyl]-1-(phenylcarbamoyl)proline Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC1CC(C(N1C(=O)NC2=CC=CC=C2)C(=O)O)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC/C=C/C1CC(C(N1C(=O)NC2=CC=CC=C2)C(=O)O)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O5S/c1-2-3-6-13-18-16-20(25-32(30,31)19-14-9-5-10-15-19)21(22(27)28)26(18)23(29)24-17-11-7-4-8-12-17/h4-15,18,20-21,25H,2-3,16H2,1H3,(H,24,29)(H,27,28)/b13-6+