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

Systemtic Name: (4-cyanophenyl)methyl 4-[(4-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (4-cyanophenyl)methyl 4-[(4-nitrophenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: 4-[(4-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 4-[(4-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: 4-(4-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=C(C=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4C(=C3C1)C(=O)OCC5=CC=C(C=C5)C#N

Isomeric SMILES

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

InChI

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