(4-tert-butylphenyl)-[(5S)-5-(4-chlorophenyl)-3-ethyl-5-oxidanyl-4H-pyrazol-1-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[(5S)-5-(4-chlorophenyl)-3-ethyl-5-oxidanyl-4H-pyrazol-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[(5S)-5-(4-chlorophenyl)-3-ethyl-5-hydroxy-4H-pyrazol-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[(5S)-5-(4-chlorophenyl)-3-ethyl-5-hydroxy-4H-pyrazol-1-yl]methanone IUPAC Name: (4-tert-butylphenyl)-[(5S)-5-(4-chlorophenyl)-3-ethyl-5-hydroxy-4H-pyrazol-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[(5S)-5-(4-chlorophenyl)-3-ethyl-5-hydroxy-2-pyrazolin-1-yl]methanone Formula: C22H25ClN2O2 MolecularWeight: 384.8991

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(C1)(C2=CC=C(C=C2)Cl)O)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H25ClN2O2/c1-5-19-14-22(27,17-10-12-18(23)13-11-17)25(24-19)20(26)15-6-8-16(9-7-15)21(2,3)4/h6-13,27H,5,14H2,1-4H3/t22-/m0/s1