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

Systemtic Name: 1-[(3S)-5-(4-bromophenyl)-3-(2-hydroxyphenyl)-1,3-dihydropyrazol-2-yl]propan-1-one Openeye Name: 1-[(3S)-5-(4-bromophenyl)-3-(2-hydroxyphenyl)-1,3-dihydropyrazol-2-yl]propan-1-one CAS Name: 1-[(3S)-5-(4-bromophenyl)-3-(2-hydroxyphenyl)-1,3-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 1-[(3S)-5-(4-bromophenyl)-3-(2-hydroxyphenyl)-1,3-dihydropyrazol-2-yl]propan-1-one Traditional Name: 1-[(5S)-3-(4-bromophenyl)-5-(2-hydroxyphenyl)-3-pyrazolin-1-yl]propan-1-one Formula: C18H17BrN2O2 MolecularWeight: 373.24378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(C=C(N1)C2=CC=C(C=C2)Br)C3=CC=CC=C3O

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrN2O2/c1-2-18(23)21-16(14-5-3-4-6-17(14)22)11-15(20-21)12-7-9-13(19)10-8-12/h3-11,16,20,22H,2H2,1H3/t16-/m0/s1