2-[butanoyl(methyl)amino]-3-sulfo-propanoic acid

Systemtic Name: 2-[butanoyl(methyl)amino]-3-sulfo-propanoic acid Openeye Name: 2-[butanoyl(methyl)amino]-3-sulfo-propanoic acid CAS Name: 2-[methyl(1-oxobutyl)amino]-3-sulfopropanoic acid IUPAC Name: 2-[butanoyl(methyl)amino]-3-sulfopropanoic acid Traditional Name: 2-[butyryl(methyl)amino]-3-sulfo-propionic acid Formula: C8H15NO6S MolecularWeight: 253.2728

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C)C(CS(=O)(=O)O)C(=O)O

Isomeric SMILES

CCCC(=O)N(C)C(CS(=O)(=O)O)C(=O)O

InChI

InChI=1S/C8H15NO6S/c1-3-4-7(10)9(2)6(8(11)12)5-16(13,14)15/h6H,3-5H2,1-2H3,(H,11,12)(H,13,14,15)