2-(3-ethanoylpyridin-1-ium-1-yl)-1-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(3-ethanoylpyridin-1-ium-1-yl)-1-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(3-acetyl-1-pyridin-1-iumyl)-1-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-(3-acetylpyridin-1-ium-1-yl)-1-[(5R)-5-(4-methoxyphenyl)-3-phenyl-2-pyrazolin-1-yl]ethanone Formula: C25H24N3O3+ MolecularWeight: 414.47636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C[N+](=CC=C1)CC(=O)N2C(CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)C1=C[N+](=CC=C1)CC(=O)N2[C@H](CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H24N3O3/c1-18(29)21-9-6-14-27(16-21)17-25(30)28-24(20-10-12-22(31-2)13-11-20)15-23(26-28)19-7-4-3-5-8-19/h3-14,16,24H,15,17H2,1-2H3/q+1/t24-/m1/s1