N-(cyclohexen-1-yl)-2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-2-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-ium-1-yl]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-(2-furylmethyl)acetamide CAS Name: 2-[4-(4-acetyl-2-fluorophenyl)-1-piperazin-1-iumyl]-N-(1-cyclohexenyl)-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[4-(4-acetyl-2-fluorophenyl)piperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-ium-1-yl]-N-(cyclohexen-1-yl)-N-(2-furfuryl)acetamide Formula: C25H31FN3O3+ MolecularWeight: 440.530343

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CC(=O)N(CC3=CC=CO3)C4=CCCCC4)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CC(=O)N(CC3=CC=CO3)C4=CCCCC4)F

InChI

InChI=1S/C25H30FN3O3/c1-19(30)20-9-10-24(23(26)16-20)28-13-11-27(12-14-28)18-25(31)29(17-22-8-5-15-32-22)21-6-3-2-4-7-21/h5-6,8-10,15-16H,2-4,7,11-14,17-18H2,1H3/p+1