2-[2-fluoranyl-5-(4-methylpiperazin-1-yl)-4-nitro-phenyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[2-fluoranyl-5-(4-methylpiperazin-1-yl)-4-nitro-phenyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[2-fluoro-5-(4-methylpiperazin-1-yl)-4-nitro-phenyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[2-fluoro-5-(4-methyl-1-piperazinyl)-4-nitrophenyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[2-fluoro-5-(4-methylpiperazin-1-yl)-4-nitrophenyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[2-fluoro-5-(4-methylpiperazino)-4-nitro-phenyl]-3,4-dihydro-1H-isoquinoline Formula: C20H23FN4O2 MolecularWeight: 370.420623

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H23FN4O2/c1-22-8-10-23(11-9-22)19-13-18(17(21)12-20(19)25(26)27)24-7-6-15-4-2-3-5-16(15)14-24/h2-5,12-13H,6-11,14H2,1H3