2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]-4-nitro-phenol

Systemtic Name: 2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]-4-nitro-phenol Openeye Name: 2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]-4-nitro-phenol CAS Name: 2-[[7-methoxy-2-(trifluoromethyl)-4-quinazolinyl]amino]-4-nitrophenol IUPAC Name: 2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]-4-nitrophenol Traditional Name: 2-[[7-methoxy-2-(trifluoromethyl)quinazolin-4-yl]amino]-4-nitro-phenol Formula: C16H11F3N4O4 MolecularWeight: 380.27815

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NC(=N2)C(F)(F)F)NC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NC(=N2)C(F)(F)F)NC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C16H11F3N4O4/c1-27-9-3-4-10-11(7-9)21-15(16(17,18)19)22-14(10)20-12-6-8(23(25)26)2-5-13(12)24/h2-7,24H,1H3,(H,20,21,22)