3-ethoxy-2-phenoxy-2-phenyl-propanoic acid; N-methyl-1,3-benzoxazol-2-amine

Systemtic Name: 3-ethoxy-2-phenoxy-2-phenyl-propanoic acid; N-methyl-1,3-benzoxazol-2-amine Openeye Name: 3-ethoxy-2-phenoxy-2-phenyl-propanoic acid; N-methyl-1,3-benzoxazol-2-amine CAS Name: 3-ethoxy-2-phenoxy-2-phenylpropanoic acid; N-methyl-1,3-benzoxazol-2-amine IUPAC Name: 3-ethoxy-2-phenoxy-2-phenylpropanoic acid; N-methyl-1,3-benzoxazol-2-amine Traditional Name: 1,3-benzoxazol-2-yl(methyl)amine; 3-ethoxy-2-phenoxy-2-phenyl-propionic acid Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(C1=CC=CC=C1)(C(=O)O)OC2=CC=CC=C2.CNC1=NC2=CC=CC=C2O1

Isomeric SMILES

CCOCC(C1=CC=CC=C1)(C(=O)O)OC2=CC=CC=C2.CNC1=NC2=CC=CC=C2O1

InChI

InChI=1S/C17H18O4.C8H8N2O/c1-2-20-13-17(16(18)19,14-9-5-3-6-10-14)21-15-11-7-4-8-12-15;1-9-8-10-6-4-2-3-5-7(6)11-8/h3-12H,2,13H2,1H3,(H,18,19);2-5H,1H3,(H,9,10)