9-[(4-tert-butylphenyl)methyl]-6-oxidanyl-1H-pyrano[3,4-b]indole-3,4-dione

Systemtic Name: 9-[(4-tert-butylphenyl)methyl]-6-oxidanyl-1H-pyrano[3,4-b]indole-3,4-dione Openeye Name: 9-[(4-tert-butylphenyl)methyl]-6-hydroxy-1H-pyrano[3,4-b]indole-3,4-dione CAS Name: 9-[(4-tert-butylphenyl)methyl]-6-hydroxy-1H-pyrano[3,4-b]indole-3,4-dione IUPAC Name: 9-[(4-tert-butylphenyl)methyl]-6-hydroxy-1H-pyrano[3,4-b]indole-3,4-dione Traditional Name: 9-(4-tert-butylbenzyl)-6-hydroxy-1H-pyran[3,4-b]indole-3,4-quinone Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C3=C(C4=C2C=CC(=C4)O)C(=O)C(=O)OC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C3=C(C4=C2C=CC(=C4)O)C(=O)C(=O)OC3

InChI

InChI=1S/C22H21NO4/c1-22(2,3)14-6-4-13(5-7-14)11-23-17-9-8-15(24)10-16(17)19-18(23)12-27-21(26)20(19)25/h4-10,24H,11-12H2,1-3H3