3-methoxy-4-[5-[3-(methoxymethyl)-4-(2-methylphenyl)phenyl]-1,2,4-oxadiazol-3-yl]benzoic acid

Systemtic Name: 3-methoxy-4-[5-[3-(methoxymethyl)-4-(2-methylphenyl)phenyl]-1,2,4-oxadiazol-3-yl]benzoic acid Openeye Name: 3-methoxy-4-[5-[3-(methoxymethyl)-4-(o-tolyl)phenyl]-1,2,4-oxadiazol-3-yl]benzoic acid CAS Name: 3-methoxy-4-[5-[3-(methoxymethyl)-4-(2-methylphenyl)phenyl]-1,2,4-oxadiazol-3-yl]benzoic acid IUPAC Name: 3-methoxy-4-[5-[3-(methoxymethyl)-4-(2-methylphenyl)phenyl]-1,2,4-oxadiazol-3-yl]benzoic acid Traditional Name: 3-methoxy-4-[5-[3-(methoxymethyl)-4-(o-tolyl)phenyl]-1,2,4-oxadiazol-3-yl]benzoic acid Formula: C25H22N2O5 MolecularWeight: 430.45258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=C(C=C2)C3=NC(=NO3)C4=C(C=C(C=C4)C(=O)O)OC)COC

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=C(C=C2)C3=NC(=NO3)C4=C(C=C(C=C4)C(=O)O)OC)COC

InChI

InChI=1S/C25H22N2O5/c1-15-6-4-5-7-19(15)20-10-8-16(12-18(20)14-30-2)24-26-23(27-32-24)21-11-9-17(25(28)29)13-22(21)31-3/h4-13H,14H2,1-3H3,(H,28,29)