(3E)-3-[(3-nitrophenyl)methylidene]-2,4-dihydro-1H-pyrrolo[1,2-a]quinazolin-10-ium-5-one

Systemtic Name: (3E)-3-[(3-nitrophenyl)methylidene]-2,4-dihydro-1H-pyrrolo[1,2-a]quinazolin-10-ium-5-one Openeye Name: (3E)-3-[(3-nitrophenyl)methylene]-2,4-dihydro-1H-pyrrolo[1,2-a]quinazolin-10-ium-5-one CAS Name: (3E)-3-[(3-nitrophenyl)methylidene]-2,4-dihydro-1H-pyrrolo[1,2-a]quinazolin-10-ium-5-one IUPAC Name: (3E)-3-[(3-nitrophenyl)methylidene]-2,4-dihydro-1H-pyrrolo[1,2-a]quinazolin-10-ium-5-one Traditional Name: (3E)-3-(3-nitrobenzylidene)-2,4-dihydro-1H-pyrrolo[1,2-a]quinazolin-10-ium-5-one Formula: C18H14N3O3+ MolecularWeight: 320.32206

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2=C(C1=CC3=CC(=CC=C3)[N+](=O)[O-])NC(=O)C4=CC=CC=C42

Isomeric SMILES

C\1C[N+]2=C(/C1=C/C3=CC(=CC=C3)[N+](=O)[O-])NC(=O)C4=CC=CC=C42

InChI

InChI=1S/C18H13N3O3/c22-18-15-6-1-2-7-16(15)20-9-8-13(17(20)19-18)10-12-4-3-5-14(11-12)21(23)24/h1-7,10-11H,8-9H2/p+1/b13-10+