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

Systemtic Name: [1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] (4E)-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] (4E)-4-[(3-nitrophenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid [1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopropylamino)-1-oxopropan-2-yl] (4E)-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-(3-nitrobenzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid [2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C27H25N3O5 MolecularWeight: 471.5045

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)OC(=O)C2=C3CCCC(=CC4=CC(=CC=C4)[N+](=O)[O-])C3=NC5=CC=CC=C52

Isomeric SMILES

CC(C(=O)NC1CC1)OC(=O)C2=C3CCC/C(=C\C4=CC(=CC=C4)[N+](=O)[O-])/C3=NC5=CC=CC=C52

InChI

InChI=1S/C27H25N3O5/c1-16(26(31)28-19-12-13-19)35-27(32)24-21-9-2-3-11-23(21)29-25-18(7-5-10-22(24)25)14-17-6-4-8-20(15-17)30(33)34/h2-4,6,8-9,11,14-16,19H,5,7,10,12-13H2,1H3,(H,28,31)/b18-14+