(3-bromophenyl)-[(5S)-3-ethyl-5-(4-methoxyphenyl)-5-oxidanyl-4H-pyrazol-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[(5S)-3-ethyl-5-(4-methoxyphenyl)-5-oxidanyl-4H-pyrazol-1-yl]methanone Openeye Name: (3-bromophenyl)-[(5S)-3-ethyl-5-hydroxy-5-(4-methoxyphenyl)-4H-pyrazol-1-yl]methanone CAS Name: (3-bromophenyl)-[(5S)-3-ethyl-5-hydroxy-5-(4-methoxyphenyl)-4H-pyrazol-1-yl]methanone IUPAC Name: (3-bromophenyl)-[(5S)-3-ethyl-5-hydroxy-5-(4-methoxyphenyl)-4H-pyrazol-1-yl]methanone Traditional Name: (3-bromophenyl)-[(5S)-3-ethyl-5-hydroxy-5-(4-methoxyphenyl)-2-pyrazolin-1-yl]methanone Formula: C19H19BrN2O3 MolecularWeight: 403.26976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(C1)(C2=CC=C(C=C2)OC)O)C(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCC1=NN([C@](C1)(C2=CC=C(C=C2)OC)O)C(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H19BrN2O3/c1-3-16-12-19(24,14-7-9-17(25-2)10-8-14)22(21-16)18(23)13-5-4-6-15(20)11-13/h4-11,24H,3,12H2,1-2H3/t19-/m0/s1