1-azanyl-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)anthracene-9,10-dione Openeye Name: 1-amino-4-(3,5-ditert-butyl-4-hydroxy-phenyl)anthracene-9,10-dione CAS Name: 1-amino-4-(3,5-ditert-butyl-4-hydroxyphenyl)anthracene-9,10-dione IUPAC Name: 1-amino-4-(3,5-ditert-butyl-4-hydroxyphenyl)anthracene-9,10-dione Traditional Name: 1-amino-4-(3,5-ditert-butyl-4-hydroxy-phenyl)-9,10-anthraquinone Formula: C28H29NO3 MolecularWeight: 427.53476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C2=C3C(=C(C=C2)N)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C28H29NO3/c1-27(2,3)19-13-15(14-20(26(19)32)28(4,5)6)16-11-12-21(29)23-22(16)24(30)17-9-7-8-10-18(17)25(23)31/h7-14,32H,29H2,1-6H3