2-[[4-(2-chloranylphenoxy)phenyl]sulfonylamino]hexanoic acid

Systemtic Name: 2-[[4-(2-chloranylphenoxy)phenyl]sulfonylamino]hexanoic acid Openeye Name: 2-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]hexanoic acid CAS Name: 2-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]hexanoic acid IUPAC Name: 2-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]hexanoic acid Traditional Name: 2-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]hexanoic acid Formula: C18H20ClNO5S MolecularWeight: 397.8731

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)OC2=CC=CC=C2Cl

Isomeric SMILES

CCCCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)OC2=CC=CC=C2Cl

InChI

InChI=1S/C18H20ClNO5S/c1-2-3-7-16(18(21)22)20-26(23,24)14-11-9-13(10-12-14)25-17-8-5-4-6-15(17)19/h4-6,8-12,16,20H,2-3,7H2,1H3,(H,21,22)