6,7a-ditert-butyl-2-(4-methylphenyl)-3-phenyl-3,3a-dihydro-1,2-benzoxazole-4,5-dione

Systemtic Name: 6,7a-ditert-butyl-2-(4-methylphenyl)-3-phenyl-3,3a-dihydro-1,2-benzoxazole-4,5-dione Openeye Name: 6,7a-ditert-butyl-3-phenyl-2-(p-tolyl)-3,3a-dihydro-1,2-benzoxazole-4,5-dione CAS Name: 6,7a-ditert-butyl-2-(4-methylphenyl)-3-phenyl-3,3a-dihydro-1,2-benzoxazole-4,5-dione IUPAC Name: 6,7a-ditert-butyl-2-(4-methylphenyl)-3-phenyl-3,3a-dihydro-1,2-benzoxazole-4,5-dione Traditional Name: 6,7a-ditert-butyl-3-phenyl-2-(p-tolyl)-3,3a-dihydroindoxazene-4,5-quinone Formula: C28H33NO3 MolecularWeight: 431.56652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C3C(=O)C(=O)C(=CC3(O2)C(C)(C)C)C(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C3C(=O)C(=O)C(=CC3(O2)C(C)(C)C)C(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C28H33NO3/c1-18-13-15-20(16-14-18)29-23(19-11-9-8-10-12-19)22-25(31)24(30)21(26(2,3)4)17-28(22,32-29)27(5,6)7/h8-17,22-23H,1-7H3