[2-oxidanylidene-2-(propan-2-ylamino)ethyl] (4E)-4-[(4-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylamino)ethyl] (4E)-4-[(4-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [2-(isopropylamino)-2-oxo-ethyl] (4E)-4-[(4-nitrophenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-[(4-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid [2-oxo-2-(propan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylamino)ethyl] (4E)-4-[(4-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-(4-nitrobenzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-(isopropylamino)-2-keto-ethyl] ester Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)COC(=O)C1=C2CCCC(=CC3=CC=C(C=C3)[N+](=O)[O-])C2=NC4=CC=CC=C41

Isomeric SMILES

CC(C)NC(=O)COC(=O)C1=C2CCC/C(=C\C3=CC=C(C=C3)[N+](=O)[O-])/C2=NC4=CC=CC=C41

InChI

InChI=1S/C26H25N3O5/c1-16(2)27-23(30)15-34-26(31)24-20-7-3-4-9-22(20)28-25-18(6-5-8-21(24)25)14-17-10-12-19(13-11-17)29(32)33/h3-4,7,9-14,16H,5-6,8,15H2,1-2H3,(H,27,30)/b18-14+