5-[4-(4-fluorophenyl)piperazin-1-yl]-8-nitro-isoquinoline

Systemtic Name: 5-[4-(4-fluorophenyl)piperazin-1-yl]-8-nitro-isoquinoline Openeye Name: 5-[4-(4-fluorophenyl)piperazin-1-yl]-8-nitro-isoquinoline CAS Name: 5-[4-(4-fluorophenyl)-1-piperazinyl]-8-nitroisoquinoline IUPAC Name: 5-[4-(4-fluorophenyl)piperazin-1-yl]-8-nitroisoquinoline Traditional Name: 5-[4-(4-fluorophenyl)piperazino]-8-nitro-isoquinoline Formula: C19H17FN4O2 MolecularWeight: 352.362283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17FN4O2/c20-14-1-3-15(4-2-14)22-9-11-23(12-10-22)18-5-6-19(24(25)26)17-13-21-8-7-16(17)18/h1-8,13H,9-12H2