(4E)-4-[(4-chloranyl-3-nitro-phenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid

Systemtic Name: (4E)-4-[(4-chloranyl-3-nitro-phenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Openeye Name: (4E)-4-[(4-chloro-3-nitro-phenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylic acid CAS Name: (4E)-4-[(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid IUPAC Name: (4E)-4-[(4-chloro-3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Traditional Name: (4E)-4-(4-chloro-3-nitro-benzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid Formula: C21H15ClN2O4 MolecularWeight: 394.8078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1C/C(=C\C2=CC(=C(C=C2)Cl)[N+](=O)[O-])/C3=NC4=CC=CC=C4C(=C3C1)C(=O)O

InChI

InChI=1S/C21H15ClN2O4/c22-16-9-8-12(11-18(16)24(27)28)10-13-4-3-6-15-19(21(25)26)14-5-1-2-7-17(14)23-20(13)15/h1-2,5,7-11H,3-4,6H2,(H,25,26)/b13-10+