2-methylidene-7-sulfo-heptanoic acid

Systemtic Name: 2-methylidene-7-sulfo-heptanoic acid Openeye Name: 2-methylene-7-sulfo-heptanoic acid CAS Name: 2-methylene-7-sulfoheptanoic acid IUPAC Name: 2-methylidene-7-sulfoheptanoic acid Traditional Name: 2-(5-sulfopentyl)acrylic acid Formula: C8H14O5S MolecularWeight: 222.25876

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CCCCCS(=O)(=O)O)C(=O)O

Isomeric SMILES

C=C(CCCCCS(=O)(=O)O)C(=O)O

InChI

InChI=1S/C8H14O5S/c1-7(8(9)10)5-3-2-4-6-14(11,12)13/h1-6H2,(H,9,10)(H,11,12,13)