2-(2-methylpropanoylamino)-3-sulfo-propanoic acid

Systemtic Name: 2-(2-methylpropanoylamino)-3-sulfo-propanoic acid Openeye Name: 2-(2-methylpropanoylamino)-3-sulfo-propanoic acid CAS Name: 2-[(2-methyl-1-oxopropyl)amino]-3-sulfopropanoic acid IUPAC Name: 2-(2-methylpropanoylamino)-3-sulfopropanoic acid Traditional Name: 2-(isobutyrylamino)-3-sulfo-propionic acid Formula: C7H13NO6S MolecularWeight: 239.24622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(CS(=O)(=O)O)C(=O)O

Isomeric SMILES

CC(C)C(=O)NC(CS(=O)(=O)O)C(=O)O

InChI

InChI=1S/C7H13NO6S/c1-4(2)6(9)8-5(7(10)11)3-15(12,13)14/h4-5H,3H2,1-2H3,(H,8,9)(H,10,11)(H,12,13,14)