5,6-bis[(3-methyl-4-oxidanyl-phenyl)amino]isoindole-1,3-dione

Systemtic Name: 5,6-bis[(3-methyl-4-oxidanyl-phenyl)amino]isoindole-1,3-dione Openeye Name: 5,6-bis(4-hydroxy-3-methyl-anilino)isoindoline-1,3-dione CAS Name: 5,6-bis(4-hydroxy-3-methylanilino)isoindole-1,3-dione IUPAC Name: 5,6-bis(4-hydroxy-3-methylanilino)isoindole-1,3-dione Traditional Name: 5,6-bis(4-hydroxy-3-methyl-anilino)isoindoline-1,3-quinone Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=C(C=C3C(=C2)C(=O)NC3=O)NC4=CC(=C(C=C4)O)C)O

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=C(C=C3C(=C2)C(=O)NC3=O)NC4=CC(=C(C=C4)O)C)O

InChI

InChI=1S/C22H19N3O4/c1-11-7-13(3-5-19(11)26)23-17-9-15-16(22(29)25-21(15)28)10-18(17)24-14-4-6-20(27)12(2)8-14/h3-10,23-24,26-27H,1-2H3,(H,25,28,29)