3-(4-ethoxyphenyl)-3-[(phenylmethyl)sulfonylamino]propanoic acid

Systemtic Name: 3-(4-ethoxyphenyl)-3-[(phenylmethyl)sulfonylamino]propanoic acid Openeye Name: 3-(benzylsulfonylamino)-3-(4-ethoxyphenyl)propanoic acid CAS Name: 3-(4-ethoxyphenyl)-3-[(phenylmethyl)sulfonylamino]propanoic acid IUPAC Name: 3-(benzylsulfonylamino)-3-(4-ethoxyphenyl)propanoic acid Traditional Name: 3-(benzylsulfonylamino)-3-p-phenetyl-propionic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CCOC1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H21NO5S/c1-2-24-16-10-8-15(9-11-16)17(12-18(20)21)19-25(22,23)13-14-6-4-3-5-7-14/h3-11,17,19H,2,12-13H2,1H3,(H,20,21)