(4R)-5-fluoranyl-4-(4-methylpiperazine-1,4-diium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (4R)-5-fluoranyl-4-(4-methylpiperazine-1,4-diium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (4R)-5-fluoro-4-(4-methylpiperazine-1,4-diium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (4R)-5-fluoro-4-(4-methyl-1-piperazine-1,4-diiumyl)-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (4R)-5-fluoro-4-(4-methylpiperazine-1,4-diium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (4R)-5-fluoro-4-(4-methylpiperazine-1,4-diium-1-yl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C14H23FN3+3 MolecularWeight: 252.350923

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C2C[NH2+]CC3=C2C(=CC=C3)F

Isomeric SMILES

C[NH+]1CC[NH+](CC1)[C@H]2C[NH2+]CC3=C2C(=CC=C3)F

InChI

InChI=1S/C14H20FN3/c1-17-5-7-18(8-6-17)13-10-16-9-11-3-2-4-12(15)14(11)13/h2-4,13,16H,5-10H2,1H3/p+3/t13-/m0/s1