1-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]anthracene-9,10-dione

Systemtic Name: 1-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]anthracene-9,10-dione Openeye Name: 1-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]anthracene-9,10-dione CAS Name: 1-[[6,7-dimethoxy-2-(trifluoromethyl)-4-quinazolinyl]amino]anthracene-9,10-dione IUPAC Name: 1-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]anthracene-9,10-dione Traditional Name: 1-[[6,7-dimethoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]-9,10-anthraquinone Formula: C25H16F3N3O4 MolecularWeight: 479.40745

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NC3=CC=CC4=C3C(=O)C5=CC=CC=C5C4=O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)C(F)(F)F)NC3=CC=CC4=C3C(=O)C5=CC=CC=C5C4=O)OC

InChI

InChI=1S/C25H16F3N3O4/c1-34-18-10-15-17(11-19(18)35-2)30-24(25(26,27)28)31-23(15)29-16-9-5-8-14-20(16)22(33)13-7-4-3-6-12(13)21(14)32/h3-11H,1-2H3,(H,29,30,31)