3-(4-ethoxy-3-methoxy-phenyl)-3-(phenylsulfonylamino)propanoic acid

Systemtic Name: 3-(4-ethoxy-3-methoxy-phenyl)-3-(phenylsulfonylamino)propanoic acid Openeye Name: 3-(benzenesulfonamido)-3-(4-ethoxy-3-methoxy-phenyl)propanoic acid CAS Name: 3-(benzenesulfonamido)-3-(4-ethoxy-3-methoxyphenyl)propanoic acid IUPAC Name: 3-(benzenesulfonamido)-3-(4-ethoxy-3-methoxyphenyl)propanoic acid Traditional Name: 3-(benzenesulfonamido)-3-(4-ethoxy-3-methoxy-phenyl)propionic acid Formula: C18H21NO6S MolecularWeight: 379.42744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21NO6S/c1-3-25-16-10-9-13(11-17(16)24-2)15(12-18(20)21)19-26(22,23)14-7-5-4-6-8-14/h4-11,15,19H,3,12H2,1-2H3,(H,20,21)