8-[6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline

Systemtic Name: 8-[6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline Openeye Name: 8-[6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline CAS Name: 8-[[6-[4-(2-fluorophenyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]oxy]-2-methylquinoline IUPAC Name: 8-[6-[4-(2-fluorophenyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]oxy-2-methylquinoline Traditional Name: 8-[6-[4-(2-fluorophenyl)piperazino]-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline Formula: C24H21FN6O3 MolecularWeight: 460.460343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])N4CCN(CC4)C5=CC=CC=C5F)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])N4CCN(CC4)C5=CC=CC=C5F)C=C1

InChI

InChI=1S/C24H21FN6O3/c1-16-9-10-17-5-4-8-20(21(17)28-16)34-24-22(31(32)33)23(26-15-27-24)30-13-11-29(12-14-30)19-7-3-2-6-18(19)25/h2-10,15H,11-14H2,1H3