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

Systemtic Name: 3-(2-ethylhexylamino)-2-sulfo-propanoic acid Openeye Name: 3-(2-ethylhexylamino)-2-sulfo-propanoic acid CAS Name: 3-(2-ethylhexylamino)-2-sulfopropanoic acid IUPAC Name: 3-(2-ethylhexylamino)-2-sulfopropanoic acid Traditional Name: 3-(2-ethylhexylamino)-2-sulfo-propionic acid Formula: C11H23NO5S MolecularWeight: 281.36902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNCC(C(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCC(CC)CNCC(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C11H23NO5S/c1-3-5-6-9(4-2)7-12-8-10(11(13)14)18(15,16)17/h9-10,12H,3-8H2,1-2H3,(H,13,14)(H,15,16,17)