N-(4-fluorophenyl)-2-[4-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[4-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[4-[(2-hydroxy-5-isopropyl-4-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(4-fluorophenyl)-2-[4-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[4-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[4-(2-hydroxy-5-isopropyl-4-methyl-benzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C23H32FN3O2+2 MolecularWeight: 401.517483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)C)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F)O

Isomeric SMILES

CC1=CC(=C(C=C1C(C)C)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F)O

InChI

InChI=1S/C23H30FN3O2/c1-16(2)21-13-18(22(28)12-17(21)3)14-26-8-10-27(11-9-26)15-23(29)25-20-6-4-19(24)5-7-20/h4-7,12-13,16,28H,8-11,14-15H2,1-3H3,(H,25,29)/p+2