2-[8-[(4-chlorophenyl)sulfonylamino]-1-pyridin-3-yl-octan-4-yl]oxyethanoic acid

Systemtic Name: 2-[8-[(4-chlorophenyl)sulfonylamino]-1-pyridin-3-yl-octan-4-yl]oxyethanoic acid Openeye Name: 2-[5-[(4-chlorophenyl)sulfonylamino]-1-[3-(3-pyridyl)propyl]pentoxy]acetic acid CAS Name: 2-[8-[(4-chlorophenyl)sulfonylamino]-1-(3-pyridinyl)octan-4-yl]oxyacetic acid IUPAC Name: 2-[8-[(4-chlorophenyl)sulfonylamino]-1-pyridin-3-yloctan-4-yl]oxyacetic acid Traditional Name: 2-[5-[(4-chlorophenyl)sulfonylamino]-1-[3-(3-pyridyl)propyl]pentoxy]acetic acid Formula: C21H27ClN2O5S MolecularWeight: 454.96748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCC(CCCCNS(=O)(=O)C2=CC=C(C=C2)Cl)OCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CCCC(CCCCNS(=O)(=O)C2=CC=C(C=C2)Cl)OCC(=O)O

InChI

InChI=1S/C21H27ClN2O5S/c22-18-9-11-20(12-10-18)30(27,28)24-14-2-1-7-19(29-16-21(25)26)8-3-5-17-6-4-13-23-15-17/h4,6,9-13,15,19,24H,1-3,5,7-8,14,16H2,(H,25,26)