(3E)-3-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one

Systemtic Name: (3E)-3-[(3-methoxy-4-prop-2-enoxy-phenyl)methylidene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Openeye Name: (3E)-3-[(4-allyloxy-3-methoxy-phenyl)methylene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one CAS Name: (3E)-3-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one IUPAC Name: (3E)-3-[(3-methoxy-4-prop-2-enoxyphenyl)methylidene]-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Traditional Name: (3E)-3-(4-allyloxy-3-methoxy-benzylidene)-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2CCN3C2=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-])OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/2\CCN3C2=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-])OCC=C

InChI

InChI=1S/C22H19N3O5/c1-3-10-30-19-7-4-14(12-20(19)29-2)11-15-8-9-24-21(15)23-18-6-5-16(25(27)28)13-17(18)22(24)26/h3-7,11-13H,1,8-10H2,2H3/b15-11+