2,2-bis[4-(1,3-benzoxazol-2-ylmethoxy)phenyl]pentanoic acid

Systemtic Name: 2,2-bis[4-(1,3-benzoxazol-2-ylmethoxy)phenyl]pentanoic acid Openeye Name: 2,2-bis[4-(1,3-benzoxazol-2-ylmethoxy)phenyl]pentanoic acid CAS Name: 2,2-bis[4-(1,3-benzoxazol-2-ylmethoxy)phenyl]pentanoic acid IUPAC Name: 2,2-bis[4-(1,3-benzoxazol-2-ylmethoxy)phenyl]pentanoic acid Traditional Name: 2,2-bis[4-(1,3-benzoxazol-2-ylmethoxy)phenyl]valeric acid Formula: C33H28N2O6 MolecularWeight: 548.58522

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3O2)(C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6O5)C(=O)O

Isomeric SMILES

CCCC(C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3O2)(C4=CC=C(C=C4)OCC5=NC6=CC=CC=C6O5)C(=O)O

InChI

InChI=1S/C33H28N2O6/c1-2-19-33(32(36)37,22-11-15-24(16-12-22)38-20-30-34-26-7-3-5-9-28(26)40-30)23-13-17-25(18-14-23)39-21-31-35-27-8-4-6-10-29(27)41-31/h3-18H,2,19-21H2,1H3,(H,36,37)