4-(2-methylbutanoylamino)butane-1-sulfonate

Systemtic Name: 4-(2-methylbutanoylamino)butane-1-sulfonate Openeye Name: 4-(2-methylbutanoylamino)butane-1-sulfonate CAS Name: 4-[(2-methyl-1-oxobutyl)amino]-1-butanesulfonate IUPAC Name: 4-(2-methylbutanoylamino)butane-1-sulfonate Traditional Name: 4-(2-methylbutanoylamino)butane-1-sulfonate Formula: C9H18NO4S- MolecularWeight: 236.30852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H19NO4S/c1-3-8(2)9(11)10-6-4-5-7-15(12,13)14/h8H,3-7H2,1-2H3,(H,10,11)(H,12,13,14)/p-1