4-[[2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-yl]amino]benzene-1,2-diol

Systemtic Name: 4-[[2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-yl]amino]benzene-1,2-diol Openeye Name: 4-[[2-[(E)-2-(5-nitro-2-furyl)vinyl]quinazolin-4-yl]amino]benzene-1,2-diol CAS Name: 4-[[2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-4-quinazolinyl]amino]benzene-1,2-diol IUPAC Name: 4-[[2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4-yl]amino]benzene-1,2-diol Traditional Name: 4-[[2-[(E)-2-(5-nitro-2-furyl)vinyl]quinazolin-4-yl]amino]pyrocatechol Formula: C20H14N4O5 MolecularWeight: 390.34896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C=CC3=CC=C(O3)[N+](=O)[O-])NC4=CC(=C(C=C4)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)/C=C/C3=CC=C(O3)[N+](=O)[O-])NC4=CC(=C(C=C4)O)O

InChI

InChI=1S/C20H14N4O5/c25-16-8-5-12(11-17(16)26)21-20-14-3-1-2-4-15(14)22-18(23-20)9-6-13-7-10-19(29-13)24(27)28/h1-11,25-26H,(H,21,22,23)/b9-6+