1-[(3S)-5-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 1-[(3S)-5-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3S)-5-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3S)-5-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3S)-5-(2,4-dimethylphenyl)-3-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5S)-3-(2,4-dimethylphenyl)-5-(4-methoxyphenyl)-2-pyrazolin-1-yl]ethanone Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)OC)C(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NN([C@@H](C2)C3=CC=C(C=C3)OC)C(=O)C)C

InChI

InChI=1S/C20H22N2O2/c1-13-5-10-18(14(2)11-13)19-12-20(22(21-19)15(3)23)16-6-8-17(24-4)9-7-16/h5-11,20H,12H2,1-4H3/t20-/m0/s1