(3-nitrophenyl)methyl 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (3-nitrophenyl)methyl 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (3-nitrophenyl)methyl 4-[(3-nitrophenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: 4-(3-nitrobenzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid (3-nitrobenzyl) ester Formula: C28H21N3O6 MolecularWeight: 495.48284

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC(=CC=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CC(=CC2=CC(=CC=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H21N3O6/c32-28(37-17-19-7-4-10-22(16-19)31(35)36)26-23-11-1-2-13-25(23)29-27-20(8-5-12-24(26)27)14-18-6-3-9-21(15-18)30(33)34/h1-4,6-7,9-11,13-16H,5,8,12,17H2