2,6-ditert-butylphenol; N-methyl-1-phenyl-pyrazol-3-amine

Systemtic Name: 2,6-ditert-butylphenol; N-methyl-1-phenyl-pyrazol-3-amine Openeye Name: 2,6-ditert-butylphenol; N-methyl-1-phenyl-pyrazol-3-amine CAS Name: 2,6-ditert-butylphenol; N-methyl-1-phenyl-3-pyrazolamine IUPAC Name: 2,6-ditert-butylphenol; N-methyl-1-phenylpyrazol-3-amine Traditional Name: 2,6-ditert-butylphenol; methyl-(1-phenylpyrazol-3-yl)amine Formula: C24H33N3O MolecularWeight: 379.53832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=CC=C1)C(C)(C)C)O.CNC1=NN(C=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=C(C(=CC=C1)C(C)(C)C)O.CNC1=NN(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C14H22O.C10H11N3/c1-13(2,3)10-8-7-9-11(12(10)15)14(4,5)6;1-11-10-7-8-13(12-10)9-5-3-2-4-6-9/h7-9,15H,1-6H3;2-8H,1H3,(H,11,12)