8-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline

Systemtic Name: 8-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline Openeye Name: 8-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline CAS Name: 8-[[6-[4-(3-chlorophenyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]oxy]-2-methylquinoline IUPAC Name: 8-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]oxy-2-methylquinoline Traditional Name: 8-[6-[4-(3-chlorophenyl)piperazino]-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline Formula: C24H21ClN6O3 MolecularWeight: 476.91494

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=C5)Cl)C=C1

Isomeric SMILES

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

InChI

InChI=1S/C24H21ClN6O3/c1-16-8-9-17-4-2-7-20(21(17)28-16)34-24-22(31(32)33)23(26-15-27-24)30-12-10-29(11-13-30)19-6-3-5-18(25)14-19/h2-9,14-15H,10-13H2,1H3