8-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-5-nitro-quinoline

Systemtic Name: 8-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-5-nitro-quinoline Openeye Name: 8-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]-5-nitro-quinoline CAS Name: 8-[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-5-nitroquinoline IUPAC Name: 8-[4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-5-nitroquinoline Traditional Name: 8-[4-(2-chloro-4-fluoro-benzyl)piperazino]-5-nitro-quinoline Formula: C20H18ClFN4O2 MolecularWeight: 400.833923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4

InChI

InChI=1S/C20H18ClFN4O2/c21-17-12-15(22)4-3-14(17)13-24-8-10-25(11-9-24)19-6-5-18(26(27)28)16-2-1-7-23-20(16)19/h1-7,12H,8-11,13H2