(E)-1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-3-(1H-pyrazol-5-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-3-(1H-pyrazol-5-yl)prop-2-en-1-one Openeye Name: (E)-1-(3,5-ditert-butyl-4-hydroxy-phenyl)-3-(1H-pyrazol-5-yl)prop-2-en-1-one CAS Name: (E)-1-(3,5-ditert-butyl-4-hydroxyphenyl)-3-(1H-pyrazol-5-yl)-2-propen-1-one IUPAC Name: (E)-1-(3,5-ditert-butyl-4-hydroxyphenyl)-3-(1H-pyrazol-5-yl)prop-2-en-1-one Traditional Name: (E)-1-(3,5-ditert-butyl-4-hydroxy-phenyl)-3-(1H-pyrazol-5-yl)prop-2-en-1-one Formula: C20H26N2O2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C=CC2=CC=NN2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)/C=C/C2=CC=NN2

InChI

InChI=1S/C20H26N2O2/c1-19(2,3)15-11-13(12-16(18(15)24)20(4,5)6)17(23)8-7-14-9-10-21-22-14/h7-12,24H,1-6H3,(H,21,22)/b8-7+