2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]ethanesulfonic acid

Systemtic Name: 2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]ethanesulfonic acid Openeye Name: 2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]ethanesulfonic acid CAS Name: 2-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]ethanesulfonic acid IUPAC Name: 2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]ethanesulfonic acid Traditional Name: 2-(tyrosylamino)ethanesulfonic acid Formula: C11H16N2O5S MolecularWeight: 288.32014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)NCCS(=O)(=O)O)N)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)NCCS(=O)(=O)O)N)O

InChI

InChI=1S/C11H16N2O5S/c12-10(7-8-1-3-9(14)4-2-8)11(15)13-5-6-19(16,17)18/h1-4,10,14H,5-7,12H2,(H,13,15)(H,16,17,18)