1-azanyl-2-(6-bromanylhexoxy)-4-oxidanyl-anthracene-9,10-dione

Systemtic Name: 1-azanyl-2-(6-bromanylhexoxy)-4-oxidanyl-anthracene-9,10-dione Openeye Name: 1-amino-2-(6-bromohexoxy)-4-hydroxy-anthracene-9,10-dione CAS Name: 1-amino-2-(6-bromohexoxy)-4-hydroxyanthracene-9,10-dione IUPAC Name: 1-amino-2-(6-bromohexoxy)-4-hydroxyanthracene-9,10-dione Traditional Name: 1-amino-2-(6-bromohexoxy)-4-hydroxy-9,10-anthraquinone Formula: C20H20BrNO4 MolecularWeight: 418.2811

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OCCCCCCBr)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OCCCCCCBr)N

InChI

InChI=1S/C20H20BrNO4/c21-9-5-1-2-6-10-26-15-11-14(23)16-17(18(15)22)20(25)13-8-4-3-7-12(13)19(16)24/h3-4,7-8,11,23H,1-2,5-6,9-10,22H2