2-[2-[4-[(2-ethyl-1-benzofuran-3-yl)carbonyl]phenoxy]ethanoyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[2-[4-[(2-ethyl-1-benzofuran-3-yl)carbonyl]phenoxy]ethanoyl-methyl-amino]ethanoic acid Openeye Name: 2-[[2-[4-(2-ethylbenzofuran-3-carbonyl)phenoxy]acetyl]-methyl-amino]acetic acid CAS Name: 2-[[2-[4-[(2-ethyl-3-benzofuranyl)-oxomethyl]phenoxy]-1-oxoethyl]-methylamino]acetic acid IUPAC Name: 2-[[2-[4-(2-ethyl-1-benzofuran-3-carbonyl)phenoxy]acetyl]-methylamino]acetic acid Traditional Name: 2-[[2-[4-(2-ethylbenzofuran-3-carbonyl)phenoxy]acetyl]-methyl-amino]acetic acid Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC=C(C=C3)OCC(=O)N(C)CC(=O)O

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC=C(C=C3)OCC(=O)N(C)CC(=O)O

InChI

InChI=1S/C22H21NO6/c1-3-17-21(16-6-4-5-7-18(16)29-17)22(27)14-8-10-15(11-9-14)28-13-19(24)23(2)12-20(25)26/h4-11H,3,12-13H2,1-2H3,(H,25,26)