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

Systemtic Name: 3-(phenethylamino)-2-sulfo-propanoic acid Openeye Name: 3-(phenethylamino)-2-sulfo-propanoic acid CAS Name: 3-(phenethylamino)-2-sulfopropanoic acid IUPAC Name: 3-(phenethylamino)-2-sulfopropanoic acid Traditional Name: 3-(phenethylamino)-2-sulfo-propionic acid Formula: C11H15NO5S MolecularWeight: 273.3055

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCC(C(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCNCC(C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C11H15NO5S/c13-11(14)10(18(15,16)17)8-12-7-6-9-4-2-1-3-5-9/h1-5,10,12H,6-8H2,(H,13,14)(H,15,16,17)