6-[[4-(2-chloranylphenoxy)phenyl]sulfonylamino]hexanoic acid

Systemtic Name: 6-[[4-(2-chloranylphenoxy)phenyl]sulfonylamino]hexanoic acid Openeye Name: 6-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]hexanoic acid CAS Name: 6-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]hexanoic acid IUPAC Name: 6-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]hexanoic acid Traditional Name: 6-[[4-(2-chlorophenoxy)phenyl]sulfonylamino]hexanoic acid Formula: C18H20ClNO5S MolecularWeight: 397.8731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OC2=CC=C(C=C2)S(=O)(=O)NCCCCCC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)OC2=CC=C(C=C2)S(=O)(=O)NCCCCCC(=O)O)Cl

InChI

InChI=1S/C18H20ClNO5S/c19-16-6-3-4-7-17(16)25-14-9-11-15(12-10-14)26(23,24)20-13-5-1-2-8-18(21)22/h3-4,6-7,9-12,20H,1-2,5,8,13H2,(H,21,22)