(4R)-4-(4-ethylpiperazine-1,4-diium-1-yl)-7-fluoranyl-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: (4R)-4-(4-ethylpiperazine-1,4-diium-1-yl)-7-fluoranyl-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: (4R)-4-(4-ethylpiperazine-1,4-diium-1-yl)-7-fluoro-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: (4R)-4-(4-ethyl-1-piperazine-1,4-diiumyl)-7-fluoro-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: (4R)-4-(4-ethylpiperazine-1,4-diium-1-yl)-7-fluoro-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: (4R)-4-(4-ethylpiperazine-1,4-diium-1-yl)-7-fluoro-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C15H25FN3+3 MolecularWeight: 266.377503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22FN3/c1-2-18-5-7-19(8-6-18)15-11-17-10-12-9-13(16)3-4-14(12)15/h3-4,9,15,17H,2,5-8,10-11H2,1H3/p+3/t15-/m0/s1