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

Systemtic Name: (4-cyanophenyl)methyl 4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (4-cyanophenyl)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 (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)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 (4-cyanobenzyl) ester Formula: C29H21N3O4 MolecularWeight: 475.49474

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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=C(C=C5)C#N

Isomeric SMILES

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

InChI

InChI=1S/C29H21N3O4/c30-17-19-11-13-20(14-12-19)18-36-29(33)27-24-8-1-2-10-26(24)31-28-22(6-4-9-25(27)28)15-21-5-3-7-23(16-21)32(34)35/h1-3,5,7-8,10-16H,4,6,9,18H2