(E)-3-(3-sulfooxyphenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(3-sulfooxyphenyl)prop-2-enoic acid Openeye Name: (E)-3-(3-sulfooxyphenyl)prop-2-enoic acid CAS Name: (E)-3-(3-sulfooxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(3-sulfooxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3-sulfoxyphenyl)acrylic acid Formula: C9H8O6S MolecularWeight: 244.22122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC(=CC(=C1)OS(=O)(=O)O)/C=C/C(=O)O

InChI

InChI=1S/C9H8O6S/c10-9(11)5-4-7-2-1-3-8(6-7)15-16(12,13)14/h1-6H,(H,10,11)(H,12,13,14)/b5-4+