2-[3-(2,3-dihydro-1-benzofuran-5-ylmethoxycarbonylamino)phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 2-[3-(2,3-dihydro-1-benzofuran-5-ylmethoxycarbonylamino)phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 2-[3-(2,3-dihydrobenzofuran-5-ylmethoxycarbonylamino)phenyl]-2-isopropoxy-propanoic acid CAS Name: 2-[3-[[2,3-dihydrobenzofuran-5-ylmethoxy(oxo)methyl]amino]phenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 2-[3-(2,3-dihydro-1-benzofuran-5-ylmethoxycarbonylamino)phenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 2-[3-(coumaran-5-ylmethoxycarbonylamino)phenyl]-2-isopropoxy-propionic acid Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(C)(C1=CC(=CC=C1)NC(=O)OCC2=CC3=C(C=C2)OCC3)C(=O)O

Isomeric SMILES

CC(C)OC(C)(C1=CC(=CC=C1)NC(=O)OCC2=CC3=C(C=C2)OCC3)C(=O)O

InChI

InChI=1S/C22H25NO6/c1-14(2)29-22(3,20(24)25)17-5-4-6-18(12-17)23-21(26)28-13-15-7-8-19-16(11-15)9-10-27-19/h4-8,11-12,14H,9-10,13H2,1-3H3,(H,23,26)(H,24,25)