[4-[5-(diethylamino)-4-fluoranyl-2-nitro-phenyl]piperazin-1-yl]-(4-fluorophenyl)methanone

Systemtic Name: [4-[5-(diethylamino)-4-fluoranyl-2-nitro-phenyl]piperazin-1-yl]-(4-fluorophenyl)methanone Openeye Name: [4-[5-(diethylamino)-4-fluoro-2-nitro-phenyl]piperazin-1-yl]-(4-fluorophenyl)methanone CAS Name: [4-[5-(diethylamino)-4-fluoro-2-nitrophenyl]-1-piperazinyl]-(4-fluorophenyl)methanone IUPAC Name: [4-[5-(diethylamino)-4-fluoro-2-nitrophenyl]piperazin-1-yl]-(4-fluorophenyl)methanone Traditional Name: [4-[5-(diethylamino)-4-fluoro-2-nitro-phenyl]piperazino]-(4-fluorophenyl)methanone Formula: C21H24F2N4O3 MolecularWeight: 418.437066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C(=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)F)[N+](=O)[O-])F

Isomeric SMILES

CCN(CC)C1=C(C=C(C(=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)F)[N+](=O)[O-])F

InChI

InChI=1S/C21H24F2N4O3/c1-3-24(4-2)18-14-19(20(27(29)30)13-17(18)23)25-9-11-26(12-10-25)21(28)15-5-7-16(22)8-6-15/h5-8,13-14H,3-4,9-12H2,1-2H3