3-(prop-2-enoylamino)pentane-3-sulfonic acid

Systemtic Name: 3-(prop-2-enoylamino)pentane-3-sulfonic acid Openeye Name: 3-(prop-2-enoylamino)pentane-3-sulfonic acid CAS Name: 3-(1-oxoprop-2-enylamino)-3-pentanesulfonic acid IUPAC Name: 3-(prop-2-enoylamino)pentane-3-sulfonic acid Traditional Name: 3-acrylamidopentane-3-sulfonic acid Formula: C8H15NO4S MolecularWeight: 221.274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H15NO4S/c1-4-7(10)9-8(5-2,6-3)14(11,12)13/h4H,1,5-6H2,2-3H3,(H,9,10)(H,11,12,13)