6-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5-oxidanyl-2H-isoquinoline-7,8-dione

Systemtic Name: 6-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5-oxidanyl-2H-isoquinoline-7,8-dione Openeye Name: 6-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-5-hydroxy-2H-isoquinoline-7,8-dione CAS Name: 6-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-5-hydroxy-2H-isoquinoline-7,8-dione IUPAC Name: 6-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-5-hydroxy-2H-isoquinoline-7,8-dione Traditional Name: 6-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-5-hydroxy-2H-isoquinoline-7,8-quinone Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C3C=CNC=C3C(=O)C2=O)O)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C3C=CNC=C3C(=O)C2=O)O)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C23H25NO4/c1-22(2,3)15-9-12(10-16(20(15)27)23(4,5)6)17-18(25)13-7-8-24-11-14(13)19(26)21(17)28/h7-11,24-25H,1-6H3