prop-2-enoic acid; 2-(prop-2-enoylamino)butane-2-sulfonic acid

Systemtic Name: prop-2-enoic acid; 2-(prop-2-enoylamino)butane-2-sulfonic acid Openeye Name: acrylic acid; 2-(prop-2-enoylamino)butane-2-sulfonic acid CAS Name: 2-(1-oxoprop-2-enylamino)-2-butanesulfonic acid; 2-propenoic acid IUPAC Name: prop-2-enoic acid; 2-(prop-2-enoylamino)butane-2-sulfonic acid Traditional Name: 2-acrylamidobutane-2-sulfonic acid; acrylic acid Formula: C10H17NO6S MolecularWeight: 279.31008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(NC(=O)C=C)S(=O)(=O)O.C=CC(=O)O

Isomeric SMILES

CCC(C)(NC(=O)C=C)S(=O)(=O)O.C=CC(=O)O

InChI

InChI=1S/C7H13NO4S.C3H4O2/c1-4-6(9)8-7(3,5-2)13(10,11)12;1-2-3(4)5/h4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12);2H,1H2,(H,4,5)