methyl 5-[[4-bromanyl-3,5-bis(4-methoxyphenyl)pyrazol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-bromanyl-3,5-bis(4-methoxyphenyl)pyrazol-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-bromo-3,5-bis(4-methoxyphenyl)pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[4-bromo-3,5-bis(4-methoxyphenyl)-1-pyrazolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-bromo-3,5-bis(4-methoxyphenyl)pyrazol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-bromo-3,5-bis(4-methoxyphenyl)pyrazol-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C24H21BrN2O5 MolecularWeight: 497.33794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NN2CC3=CC=C(O3)C(=O)OC)C4=CC=C(C=C4)OC)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NN2CC3=CC=C(O3)C(=O)OC)C4=CC=C(C=C4)OC)Br

InChI

InChI=1S/C24H21BrN2O5/c1-29-17-8-4-15(5-9-17)22-21(25)23(16-6-10-18(30-2)11-7-16)27(26-22)14-19-12-13-20(32-19)24(28)31-3/h4-13H,14H2,1-3H3