3-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propanoyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoyl]-2H-phthalazine-1,4-dione CAS Name: 3-[3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxopropyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoyl]-2H-phthalazine-1,4-quinone Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)N2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)N2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C25H30N2O4/c1-24(2,3)18-13-15(14-19(21(18)29)25(4,5)6)11-12-20(28)27-23(31)17-10-8-7-9-16(17)22(30)26-27/h7-10,13-14,29H,11-12H2,1-6H3,(H,26,30)