2-(2-carboxyethyl)-1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]cyclopentane-1-carboxylic acid

Systemtic Name: 2-(2-carboxyethyl)-1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]cyclopentane-1-carboxylic acid Openeye Name: 2-(2-carboxyethyl)-1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]cyclopentanecarboxylic acid CAS Name: 2-(2-carboxyethyl)-1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]-1-cyclopentanecarboxylic acid IUPAC Name: 2-(2-carboxyethyl)-1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]cyclopentane-1-carboxylic acid Traditional Name: 2-(2-carboxyethyl)-1-[[4-(4-fluorophenyl)phenyl]sulfonylamino]cyclopentanecarboxylic acid Formula: C21H22FNO6S MolecularWeight: 435.465883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)F)CCC(=O)O

Isomeric SMILES

C1CC(C(C1)(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)F)CCC(=O)O

InChI

InChI=1S/C21H22FNO6S/c22-17-8-3-14(4-9-17)15-5-10-18(11-6-15)30(28,29)23-21(20(26)27)13-1-2-16(21)7-12-19(24)25/h3-6,8-11,16,23H,1-2,7,12-13H2,(H,24,25)(H,26,27)