N-(4-fluorophenyl)-2-[4-(4-propan-2-yloxyphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[4-(4-propan-2-yloxyphenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[4-(4-isopropoxybenzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-fluorophenyl)-2-[4-[oxo-(4-propan-2-yloxyphenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[4-(4-propan-2-yloxybenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[4-(4-isopropoxybenzoyl)piperazin-1-ium-1-yl]acetamide Formula: C22H27FN3O3+ MolecularWeight: 400.466483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O3/c1-16(2)29-20-9-3-17(4-10-20)22(28)26-13-11-25(12-14-26)15-21(27)24-19-7-5-18(23)6-8-19/h3-10,16H,11-15H2,1-2H3,(H,24,27)/p+1