(4-tert-butylphenyl)-(3-methyl-5-oxidanyl-5-pyridin-3-yl-4H-pyrazol-1-yl)methanone

Systemtic Name: (4-tert-butylphenyl)-(3-methyl-5-oxidanyl-5-pyridin-3-yl-4H-pyrazol-1-yl)methanone Openeye Name: (4-tert-butylphenyl)-[5-hydroxy-3-methyl-5-(3-pyridyl)-4H-pyrazol-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[5-hydroxy-3-methyl-5-(3-pyridinyl)-4H-pyrazol-1-yl]methanone IUPAC Name: (4-tert-butylphenyl)-(5-hydroxy-3-methyl-5-pyridin-3-yl-4H-pyrazol-1-yl)methanone Traditional Name: (4-tert-butylphenyl)-[5-hydroxy-3-methyl-5-(3-pyridyl)-2-pyrazolin-1-yl]methanone Formula: C20H23N3O2 MolecularWeight: 337.41552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C2=CN=CC=C2)O)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=NN(C(C1)(C2=CN=CC=C2)O)C(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C20H23N3O2/c1-14-12-20(25,17-6-5-11-21-13-17)23(22-14)18(24)15-7-9-16(10-8-15)19(2,3)4/h5-11,13,25H,12H2,1-4H3