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

Systemtic Name: 1-[(3S)-3-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]ethanone Openeye Name: 1-[(3S)-3-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]ethanone CAS Name: 1-[(3S)-3-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]ethanone IUPAC Name: 1-[(3S)-3-(2-hydroxyphenyl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-2-yl]ethanone Traditional Name: 1-[(5S)-5-(2-hydroxyphenyl)-3-(4-methoxyphenyl)-3-pyrazolin-1-yl]ethanone Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O3/c1-12(21)20-17(15-5-3-4-6-18(15)22)11-16(19-20)13-7-9-14(23-2)10-8-13/h3-11,17,19,22H,1-2H3/t17-/m0/s1