1-azanyl-4-oxidanyl-2-[3-(trifluoromethyl)phenoxy]anthracene-9,10-dione

Systemtic Name: 1-azanyl-4-oxidanyl-2-[3-(trifluoromethyl)phenoxy]anthracene-9,10-dione Openeye Name: 1-amino-4-hydroxy-2-[3-(trifluoromethyl)phenoxy]anthracene-9,10-dione CAS Name: 1-amino-4-hydroxy-2-[3-(trifluoromethyl)phenoxy]anthracene-9,10-dione IUPAC Name: 1-amino-4-hydroxy-2-[3-(trifluoromethyl)phenoxy]anthracene-9,10-dione Traditional Name: 1-amino-4-hydroxy-2-[3-(trifluoromethyl)phenoxy]-9,10-anthraquinone Formula: C21H12F3NO4 MolecularWeight: 399.31949

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OC4=CC=CC(=C4)C(F)(F)F)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)OC4=CC=CC(=C4)C(F)(F)F)N

InChI

InChI=1S/C21H12F3NO4/c22-21(23,24)10-4-3-5-11(8-10)29-15-9-14(26)16-17(18(15)25)20(28)13-7-2-1-6-12(13)19(16)27/h1-9,26H,25H2