(6E)-6-[(2-bromanyl-4-methoxy-3-oxidanyl-phenyl)methylidene]-2-nitro-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one

Systemtic Name: (6E)-6-[(2-bromanyl-4-methoxy-3-oxidanyl-phenyl)methylidene]-2-nitro-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one Openeye Name: (6E)-6-[(2-bromo-3-hydroxy-4-methoxy-phenyl)methylene]-2-nitro-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one CAS Name: (6E)-6-[(2-bromo-3-hydroxy-4-methoxyphenyl)methylidene]-2-nitro-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one IUPAC Name: (6E)-6-[(2-bromo-3-hydroxy-4-methoxyphenyl)methylidene]-2-nitro-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one Traditional Name: (6E)-6-(2-bromo-3-hydroxy-4-methoxy-benzylidene)-2-nitro-8,9-dihydro-7H-pyrido[2,1-b]quinazolin-11-one Formula: C20H16BrN3O5 MolecularWeight: 458.26214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C=C2CCCN3C2=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Br)O

Isomeric SMILES

COC1=C(C(=C(C=C1)/C=C/2\CCCN3C2=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-])Br)O

InChI

InChI=1S/C20H16BrN3O5/c1-29-16-7-4-11(17(21)18(16)25)9-12-3-2-8-23-19(12)22-15-6-5-13(24(27)28)10-14(15)20(23)26/h4-7,9-10,25H,2-3,8H2,1H3/b12-9+