4-[4-(4-fluorophenyl)piperazin-1-yl]-2-methyl-5-nitro-6-propan-2-yloxy-pyrimidine

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-2-methyl-5-nitro-6-propan-2-yloxy-pyrimidine Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-6-isopropoxy-2-methyl-5-nitro-pyrimidine CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-2-methyl-5-nitro-6-propan-2-yloxypyrimidine IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-2-methyl-5-nitro-6-propan-2-yloxypyrimidine Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-6-isopropoxy-2-methyl-5-nitro-pyrimidine Formula: C18H22FN5O3 MolecularWeight: 375.397383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)OC(C)C)[N+](=O)[O-])N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NC(=C(C(=N1)OC(C)C)[N+](=O)[O-])N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN5O3/c1-12(2)27-18-16(24(25)26)17(20-13(3)21-18)23-10-8-22(9-11-23)15-6-4-14(19)5-7-15/h4-7,12H,8-11H2,1-3H3