2-(6-sulfooxynaphthalen-2-yl)propanoic acid

Systemtic Name: 2-(6-sulfooxynaphthalen-2-yl)propanoic acid Openeye Name: 2-(6-sulfooxy-2-naphthyl)propanoic acid CAS Name: 2-(6-sulfooxy-2-naphthalenyl)propanoic acid IUPAC Name: 2-(6-sulfooxynaphthalen-2-yl)propanoic acid Traditional Name: 2-(6-sulfoxy-2-naphthyl)propionic acid Formula: C13H12O6S MolecularWeight: 296.29578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OS(=O)(=O)O)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)OS(=O)(=O)O)C(=O)O

InChI

InChI=1S/C13H12O6S/c1-8(13(14)15)9-2-3-11-7-12(19-20(16,17)18)5-4-10(11)6-9/h2-8H,1H3,(H,14,15)(H,16,17,18)