2-[[4-(4-fluorophenyl)phthalazin-1-yl]amino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]amino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[4-(4-fluorophenyl)-1-phthalazinyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]amino]ethyl-diisopropyl-ammonium Formula: C22H28FN4+ MolecularWeight: 367.482923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC1=NN=C(C2=CC=CC=C21)C3=CC=C(C=C3)F)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC1=NN=C(C2=CC=CC=C21)C3=CC=C(C=C3)F)C(C)C

InChI

InChI=1S/C22H27FN4/c1-15(2)27(16(3)4)14-13-24-22-20-8-6-5-7-19(20)21(25-26-22)17-9-11-18(23)12-10-17/h5-12,15-16H,13-14H2,1-4H3,(H,24,26)/p+1