1-[3-(4-bromophenyl)-5-(5-methylfuran-2-yl)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[3-(4-bromophenyl)-5-(5-methylfuran-2-yl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[3-(4-bromophenyl)-5-(5-methyl-2-furyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[3-(4-bromophenyl)-5-(5-methyl-2-furanyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[3-(4-bromophenyl)-5-(5-methylfuran-2-yl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[5-(4-bromophenyl)-3-(5-methyl-2-furyl)-2-pyrazolin-1-yl]ethanone Formula: C16H15BrN2O2 MolecularWeight: 347.2065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NN(C(C2)C3=CC=C(C=C3)Br)C(=O)C

Isomeric SMILES

CC1=CC=C(O1)C2=NN(C(C2)C3=CC=C(C=C3)Br)C(=O)C

InChI

InChI=1S/C16H15BrN2O2/c1-10-3-8-16(21-10)14-9-15(19(18-14)11(2)20)12-4-6-13(17)7-5-12/h3-8,15H,9H2,1-2H3