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

Systemtic Name: [1-(ethylamino)-1-oxidanylidene-propan-2-yl] (4E)-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: [2-(ethylamino)-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-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(ethylamino)-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-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C26H25N3O5 MolecularWeight: 459.4938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25N3O5/c1-3-27-25(30)16(2)34-26(31)23-20-11-4-5-13-22(20)28-24-18(9-7-12-21(23)24)14-17-8-6-10-19(15-17)29(32)33/h4-6,8,10-11,13-16H,3,7,9,12H2,1-2H3,(H,27,30)/b18-14+