N-(4-fluorophenyl)-2-[4-(5-methylfuran-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[4-(5-methylfuran-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[4-(5-methylfuran-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-fluorophenyl)-2-[4-[(5-methyl-2-furanyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[4-(5-methylfuran-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[4-(5-methyl-2-furoyl)piperazin-1-ium-1-yl]acetamide Formula: C18H21FN3O3+ MolecularWeight: 346.376043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(O1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C18H20FN3O3/c1-13-2-7-16(25-13)18(24)22-10-8-21(9-11-22)12-17(23)20-15-5-3-14(19)4-6-15/h2-7H,8-12H2,1H3,(H,20,23)/p+1