4-[2-(dioxidanyl)-2,2-bis(4-methylphenyl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole

Systemtic Name: 4-[2-(dioxidanyl)-2,2-bis(4-methylphenyl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole Openeye Name: 4-[2-hydroperoxy-2,2-bis(p-tolyl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole CAS Name: 4-[2-hydroperoxy-2,2-bis(4-methylphenyl)ethyl]-3,5-dimethyl-1-phenylpyrazole IUPAC Name: 4-[2-hydroperoxy-2,2-bis(4-methylphenyl)ethyl]-3,5-dimethyl-1-phenylpyrazole Traditional Name: 4-[2-hydroperoxy-2,2-bis(p-tolyl)ethyl]-3,5-dimethyl-1-phenyl-pyrazole Formula: C27H28N2O2 MolecularWeight: 412.52342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC2=C(N(N=C2C)C3=CC=CC=C3)C)(C4=CC=C(C=C4)C)OO

Isomeric SMILES

CC1=CC=C(C=C1)C(CC2=C(N(N=C2C)C3=CC=CC=C3)C)(C4=CC=C(C=C4)C)OO

InChI

InChI=1S/C27H28N2O2/c1-19-10-14-23(15-11-19)27(31-30,24-16-12-20(2)13-17-24)18-26-21(3)28-29(22(26)4)25-8-6-5-7-9-25/h5-17,30H,18H2,1-4H3