1-[(3R)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-pyrrolidin-1-yl-ethanone

Systemtic Name: 1-[(3R)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-pyrrolidin-1-yl-ethanone Openeye Name: 1-[(3R)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-pyrrolidin-1-yl-ethanone CAS Name: 1-[(3R)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-(1-pyrrolidinyl)ethanone IUPAC Name: 1-[(3R)-5-(4-bromophenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-pyrrolidin-1-ylethanone Traditional Name: 1-[(5R)-3-(4-bromophenyl)-5-(4-methoxyphenyl)-2-pyrazolin-1-yl]-2-pyrrolidino-ethanone Formula: C22H24BrN3O2 MolecularWeight: 442.34886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CN3CCCC3)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CC(=NN2C(=O)CN3CCCC3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H24BrN3O2/c1-28-19-10-6-17(7-11-19)21-14-20(16-4-8-18(23)9-5-16)24-26(21)22(27)15-25-12-2-3-13-25/h4-11,21H,2-3,12-15H2,1H3/t21-/m1/s1