2-[3-[[1,3-benzoxazol-2-yl-(2-ethoxy-2-oxidanylidene-ethyl)amino]methyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[3-[[1,3-benzoxazol-2-yl-(2-ethoxy-2-oxidanylidene-ethyl)amino]methyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[3-[[1,3-benzoxazol-2-yl-(2-ethoxy-2-oxo-ethyl)amino]methyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[3-[[1,3-benzoxazol-2-yl-(2-ethoxy-2-oxoethyl)amino]methyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[3-[[1,3-benzoxazol-2-yl-(2-ethoxy-2-oxoethyl)amino]methyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[3-[[1,3-benzoxazol-2-yl-(2-ethoxy-2-keto-ethyl)amino]methyl]phenoxy]-2-methyl-propionic acid Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CC(=CC=C1)OC(C)(C)C(=O)O)C2=NC3=CC=CC=C3O2

Isomeric SMILES

CCOC(=O)CN(CC1=CC(=CC=C1)OC(C)(C)C(=O)O)C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C22H24N2O6/c1-4-28-19(25)14-24(21-23-17-10-5-6-11-18(17)29-21)13-15-8-7-9-16(12-15)30-22(2,3)20(26)27/h5-12H,4,13-14H2,1-3H3,(H,26,27)