2-[2-(3-phenoxyphenyl)propanoylamino]ethanesulfonic acid

Systemtic Name: 2-[2-(3-phenoxyphenyl)propanoylamino]ethanesulfonic acid Openeye Name: 2-[2-(3-phenoxyphenyl)propanoylamino]ethanesulfonic acid CAS Name: 2-[[1-oxo-2-(3-phenoxyphenyl)propyl]amino]ethanesulfonic acid IUPAC Name: 2-[2-(3-phenoxyphenyl)propanoylamino]ethanesulfonic acid Traditional Name: 2-[2-(3-phenoxyphenyl)propanoylamino]ethanesulfonic acid Formula: C17H19NO5S MolecularWeight: 349.40146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)NCCS(=O)(=O)O

Isomeric SMILES

CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)NCCS(=O)(=O)O

InChI

InChI=1S/C17H19NO5S/c1-13(17(19)18-10-11-24(20,21)22)14-6-5-9-16(12-14)23-15-7-3-2-4-8-15/h2-9,12-13H,10-11H2,1H3,(H,18,19)(H,20,21,22)