2-[3-(4-bromophenyl)sulfonylphenoxy]pentanoic acid

Systemtic Name: 2-[3-(4-bromophenyl)sulfonylphenoxy]pentanoic acid Openeye Name: 2-[3-(4-bromophenyl)sulfonylphenoxy]pentanoic acid CAS Name: 2-[3-(4-bromophenyl)sulfonylphenoxy]pentanoic acid IUPAC Name: 2-[3-(4-bromophenyl)sulfonylphenoxy]pentanoic acid Traditional Name: 2-(3-brosylphenoxy)valeric acid Formula: C17H17BrO5S MolecularWeight: 413.28288

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)OC1=CC(=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCC(C(=O)O)OC1=CC(=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H17BrO5S/c1-2-4-16(17(19)20)23-13-5-3-6-15(11-13)24(21,22)14-9-7-12(18)8-10-14/h3,5-11,16H,2,4H2,1H3,(H,19,20)