3-(2-methylbutanoylamino)propane-1-sulfonate

Systemtic Name: 3-(2-methylbutanoylamino)propane-1-sulfonate Openeye Name: 3-(2-methylbutanoylamino)propane-1-sulfonate CAS Name: 3-[(2-methyl-1-oxobutyl)amino]-1-propanesulfonate IUPAC Name: 3-(2-methylbutanoylamino)propane-1-sulfonate Traditional Name: 3-(2-methylbutanoylamino)propane-1-sulfonate Formula: C8H16NO4S- MolecularWeight: 222.28194

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NCCCS(=O)(=O)[O-]

Isomeric SMILES

CCC(C)C(=O)NCCCS(=O)(=O)[O-]

InChI

InChI=1S/C8H17NO4S/c1-3-7(2)8(10)9-5-4-6-14(11,12)13/h7H,3-6H2,1-2H3,(H,9,10)(H,11,12,13)/p-1