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

Systemtic Name: 2-[(2-azanyl-3-phenyl-propanoyl)amino]ethanesulfonic acid Openeye Name: 2-[(2-amino-3-phenyl-propanoyl)amino]ethanesulfonic acid CAS Name: 2-[(2-amino-1-oxo-3-phenylpropyl)amino]ethanesulfonic acid IUPAC Name: 2-[(2-amino-3-phenylpropanoyl)amino]ethanesulfonic acid Traditional Name: 2-(phenylalanylamino)ethanesulfonic acid Formula: C11H16N2O4S MolecularWeight: 272.32074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O4S/c12-10(8-9-4-2-1-3-5-9)11(14)13-6-7-18(15,16)17/h1-5,10H,6-8,12H2,(H,13,14)(H,15,16,17)