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2-[4-(sulfomethyl)phenoxy]pentanoic acid

2-[4-(sulfomethyl)phenoxy]pentanoic acid

Systemtic Name:2-[4-(sulfomethyl)phenoxy]pentanoic acid
Openeye Name:2-[4-(sulfomethyl)phenoxy]pentanoic acid
CAS Name:2-[4-(sulfomethyl)phenoxy]pentanoic acid
IUPAC Name:2-[4-(sulfomethyl)phenoxy]pentanoic acid
Traditional Name:2-[4-(sulfomethyl)phenoxy]valeric acid
Formula: C12H16O6S
MolecularWeight: 288.31684
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)OC1=CC=C(C=C1)CS(=O)(=O)O


Isomeric SMILES

CCCC(C(=O)O)OC1=CC=C(C=C1)CS(=O)(=O)O


InChI

InChI=1S/C12H16O6S/c1-2-3-11(12(13)14)18-10-6-4-9(5-7-10)8-19(15,16)17/h4-7,11H,2-3,8H2,1H3,(H,13,14)(H,15,16,17)


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