2-[2-[3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 2-[2-[3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 2-[2-[3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxo-ethoxy]benzoic acid CAS Name: 2-[2-[3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]benzoic acid IUPAC Name: 2-[2-[3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]benzoic acid Traditional Name: 2-[2-keto-2-[5-(4-methoxyphenyl)-3-phenyl-2-pyrazolin-1-yl]ethoxy]benzoic acid Formula: C25H22N2O5 MolecularWeight: 430.45258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)COC3=CC=CC=C3C(=O)O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=NN2C(=O)COC3=CC=CC=C3C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O5/c1-31-19-13-11-18(12-14-19)22-15-21(17-7-3-2-4-8-17)26-27(22)24(28)16-32-23-10-6-5-9-20(23)25(29)30/h2-14,22H,15-16H2,1H3,(H,29,30)