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

Systemtic Name: 1-[(3S)-3-(4-bromophenyl)-5-(2-methoxyphenyl)-1,3-dihydropyrazol-2-yl]propan-1-one Openeye Name: 1-[(3S)-3-(4-bromophenyl)-5-(2-methoxyphenyl)-1,3-dihydropyrazol-2-yl]propan-1-one CAS Name: 1-[(3S)-3-(4-bromophenyl)-5-(2-methoxyphenyl)-1,3-dihydropyrazol-2-yl]-1-propanone IUPAC Name: 1-[(3S)-3-(4-bromophenyl)-5-(2-methoxyphenyl)-1,3-dihydropyrazol-2-yl]propan-1-one Traditional Name: 1-[(5S)-5-(4-bromophenyl)-3-(2-methoxyphenyl)-3-pyrazolin-1-yl]propan-1-one Formula: C19H19BrN2O2 MolecularWeight: 387.27036

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(C=C(N1)C2=CC=CC=C2OC)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC(=O)N1[C@@H](C=C(N1)C2=CC=CC=C2OC)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H19BrN2O2/c1-3-19(23)22-17(13-8-10-14(20)11-9-13)12-16(21-22)15-6-4-5-7-18(15)24-2/h4-12,17,21H,3H2,1-2H3/t17-/m0/s1