1-[(3S)-3-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[(3S)-3-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-methyl-propan-1-one Openeye Name: 1-[(3S)-3-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-methyl-propan-1-one CAS Name: 1-[(3S)-3-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-methyl-1-propanone IUPAC Name: 1-[(3S)-3-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-methylpropan-1-one Traditional Name: 1-[(5S)-5-(2-hydroxyphenyl)-3-(4-methoxyphenyl)-2-pyrazolin-1-yl]-2-methyl-propan-1-one Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C(CC(=N1)C2=CC=C(C=C2)OC)C3=CC=CC=C3O

Isomeric SMILES

CC(C)C(=O)N1[C@@H](CC(=N1)C2=CC=C(C=C2)OC)C3=CC=CC=C3O

InChI

InChI=1S/C20H22N2O3/c1-13(2)20(24)22-18(16-6-4-5-7-19(16)23)12-17(21-22)14-8-10-15(25-3)11-9-14/h4-11,13,18,23H,12H2,1-3H3/t18-/m0/s1