5-azanyl-1-(4-fluorophenyl)sulfonyl-5-[(E)-pent-1-enyl]-3-(phenylsulfonyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-azanyl-1-(4-fluorophenyl)sulfonyl-5-[(E)-pent-1-enyl]-3-(phenylsulfonyl)pyrrolidine-2-carboxylic acid Openeye Name: 5-amino-3-(benzenesulfonyl)-1-(4-fluorophenyl)sulfonyl-5-[(E)-pent-1-enyl]pyrrolidine-2-carboxylic acid CAS Name: 5-amino-3-(benzenesulfonyl)-1-(4-fluorophenyl)sulfonyl-5-[(E)-pent-1-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-amino-3-(benzenesulfonyl)-1-(4-fluorophenyl)sulfonyl-5-[(E)-pent-1-enyl]pyrrolidine-2-carboxylic acid Traditional Name: 5-amino-3-besyl-1-(4-fluorophenyl)sulfonyl-5-[(E)-pent-1-enyl]proline Formula: C22H25FN2O6S2 MolecularWeight: 496.572103

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC1(CC(C(N1S(=O)(=O)C2=CC=C(C=C2)F)C(=O)O)S(=O)(=O)C3=CC=CC=C3)N

Isomeric SMILES

CCC/C=C/C1(CC(C(N1S(=O)(=O)C2=CC=C(C=C2)F)C(=O)O)S(=O)(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C22H25FN2O6S2/c1-2-3-7-14-22(24)15-19(32(28,29)17-8-5-4-6-9-17)20(21(26)27)25(22)33(30,31)18-12-10-16(23)11-13-18/h4-14,19-20H,2-3,15,24H2,1H3,(H,26,27)/b14-7+