2-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-methylbutan-2-yl)ethanamide

Systemtic Name: 2-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-methylbutan-2-yl)ethanamide Openeye Name: N-(1,1-dimethylpropyl)-2-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: 2-[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(2-methylbutan-2-yl)acetamide IUPAC Name: 2-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-methylbutan-2-yl)acetamide Traditional Name: N-tert-amyl-2-[4-(5-fluoro-2-methoxy-benzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C19H32FN3O2+2 MolecularWeight: 353.474683

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C[NH+]1CC[NH+](CC1)CC2=C(C=CC(=C2)F)OC

Isomeric SMILES

CCC(C)(C)NC(=O)C[NH+]1CC[NH+](CC1)CC2=C(C=CC(=C2)F)OC

InChI

InChI=1S/C19H30FN3O2/c1-5-19(2,3)21-18(24)14-23-10-8-22(9-11-23)13-15-12-16(20)6-7-17(15)25-4/h6-7,12H,5,8-11,13-14H2,1-4H3,(H,21,24)/p+2