(3E)-7-nitro-3-[(4-pentoxyphenyl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one

Systemtic Name: (3E)-7-nitro-3-[(4-pentoxyphenyl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Openeye Name: (3E)-7-nitro-3-[(4-pentoxyphenyl)methylene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one CAS Name: (3E)-7-nitro-3-[(4-pentoxyphenyl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one IUPAC Name: (3E)-7-nitro-3-[(4-pentoxyphenyl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Traditional Name: (3E)-3-(4-amoxybenzylidene)-7-nitro-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C=C2CCN3C2=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)/C=C/2\CCN3C2=NC4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O4/c1-2-3-4-13-30-19-8-5-16(6-9-19)14-17-11-12-25-22(17)24-21-10-7-18(26(28)29)15-20(21)23(25)27/h5-10,14-15H,2-4,11-13H2,1H3/b17-14+