2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide

Systemtic Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide Openeye Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(2-isopropyl-6-methyl-phenyl)acetamide CAS Name: 2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide IUPAC Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide Traditional Name: 2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]-N-(2-isopropyl-6-methyl-phenyl)acetamide Formula: C22H29FN3O+ MolecularWeight: 370.483563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C22H28FN3O/c1-16(2)18-8-6-7-17(3)22(18)24-21(27)15-25-11-13-26(14-12-25)20-10-5-4-9-19(20)23/h4-10,16H,11-15H2,1-3H3,(H,24,27)/p+1