2-[3-(4-dibenzofuran-1-ylphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanoic acid

Systemtic Name: 2-[3-(4-dibenzofuran-1-ylphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanoic acid Openeye Name: 2-[3-(4-dibenzofuran-1-ylphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]acetic acid CAS Name: 2-[3-[4-(1-dibenzofuranyl)phenyl]-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]acetic acid IUPAC Name: 2-[3-(4-dibenzofuran-1-ylphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]acetic acid Traditional Name: 2-[5-(4-dibenzofuran-1-ylphenyl)-3-(4-methoxyphenyl)-2-pyrazolin-1-yl]acetic acid Formula: C30H24N2O4 MolecularWeight: 476.52256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)C4=C5C6=CC=CC=C6OC5=CC=C4)CC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)C4=C5C6=CC=CC=C6OC5=CC=C4)CC(=O)O

InChI

InChI=1S/C30H24N2O4/c1-35-22-15-13-20(14-16-22)25-17-26(32(31-25)18-29(33)34)21-11-9-19(10-12-21)23-6-4-8-28-30(23)24-5-2-3-7-27(24)36-28/h2-16,26H,17-18H2,1H3,(H,33,34)