3-[4-(3-oxidanylpropoxy)phenyl]-2-phenyl-5H-1,2,4-oxadiazole-5-carboxylic acid

Systemtic Name: 3-[4-(3-oxidanylpropoxy)phenyl]-2-phenyl-5H-1,2,4-oxadiazole-5-carboxylic acid Openeye Name: 3-[4-(3-hydroxypropoxy)phenyl]-2-phenyl-5H-1,2,4-oxadiazole-5-carboxylic acid CAS Name: 3-[4-(3-hydroxypropoxy)phenyl]-2-phenyl-5H-1,2,4-oxadiazole-5-carboxylic acid IUPAC Name: 3-[4-(3-hydroxypropoxy)phenyl]-2-phenyl-5H-1,2,4-oxadiazole-5-carboxylic acid Traditional Name: 3-[4-(3-hydroxypropoxy)phenyl]-2-phenyl-5H-1,2,4-oxadiazole-5-carboxylic acid Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC(O2)C(=O)O)C3=CC=C(C=C3)OCCCO

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC(O2)C(=O)O)C3=CC=C(C=C3)OCCCO

InChI

InChI=1S/C18H18N2O5/c21-11-4-12-24-15-9-7-13(8-10-15)16-19-17(18(22)23)25-20(16)14-5-2-1-3-6-14/h1-3,5-10,17,21H,4,11-12H2,(H,22,23)