3-[5,7-ditert-butyl-3-(4-hydroxyphenyl)-6-methyl-pyrazolo[1,5-a]pyrimidin-2-yl]phenol

Systemtic Name: 3-[5,7-ditert-butyl-3-(4-hydroxyphenyl)-6-methyl-pyrazolo[1,5-a]pyrimidin-2-yl]phenol Openeye Name: 3-[5,7-ditert-butyl-3-(4-hydroxyphenyl)-6-methyl-pyrazolo[1,5-a]pyrimidin-2-yl]phenol CAS Name: 3-[5,7-ditert-butyl-3-(4-hydroxyphenyl)-6-methyl-2-pyrazolo[1,5-a]pyrimidinyl]phenol IUPAC Name: 3-[5,7-ditert-butyl-3-(4-hydroxyphenyl)-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]phenol Traditional Name: 3-[5,7-ditert-butyl-3-(4-hydroxyphenyl)-6-methyl-pyrazolo[1,5-a]pyrimidin-2-yl]phenol Formula: C27H31N3O2 MolecularWeight: 429.55394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=C(C(=N2)C3=CC(=CC=C3)O)C4=CC=C(C=C4)O)N=C1C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=C(N2C(=C(C(=N2)C3=CC(=CC=C3)O)C4=CC=C(C=C4)O)N=C1C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C27H31N3O2/c1-16-23(26(2,3)4)28-25-21(17-11-13-19(31)14-12-17)22(18-9-8-10-20(32)15-18)29-30(25)24(16)27(5,6)7/h8-15,31-32H,1-7H3