[2-[3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl] 2-phenylbutanoate

Systemtic Name: [2-[3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl] 2-phenylbutanoate Openeye Name: [2-[3-(2-furyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl] 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid [2-[3-(2-furanyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl] ester IUPAC Name: [2-[3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl] 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid [2-[5-(2-furyl)-3-(4-methoxyphenyl)-2-pyrazolin-1-yl]-2-keto-ethyl] ester Formula: C26H26N2O5 MolecularWeight: 446.49504

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OCC(=O)N2C(CC(=N2)C3=CC=C(C=C3)OC)C4=CC=CO4

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OCC(=O)N2C(CC(=N2)C3=CC=C(C=C3)OC)C4=CC=CO4

InChI

InChI=1S/C26H26N2O5/c1-3-21(18-8-5-4-6-9-18)26(30)33-17-25(29)28-23(24-10-7-15-32-24)16-22(27-28)19-11-13-20(31-2)14-12-19/h4-15,21,23H,3,16-17H2,1-2H3