2-[4-(furan-3-ylcarbonyl)piperazin-1-ium-1-yl]-N-(2-methylbutan-2-yl)ethanamide

Systemtic Name: 2-[4-(furan-3-ylcarbonyl)piperazin-1-ium-1-yl]-N-(2-methylbutan-2-yl)ethanamide Openeye Name: N-(1,1-dimethylpropyl)-2-[4-(furan-3-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[3-furanyl(oxo)methyl]-1-piperazin-1-iumyl]-N-(2-methylbutan-2-yl)acetamide IUPAC Name: 2-[4-(furan-3-carbonyl)piperazin-1-ium-1-yl]-N-(2-methylbutan-2-yl)acetamide Traditional Name: N-tert-amyl-2-[4-(3-furoyl)piperazin-1-ium-1-yl]acetamide Formula: C16H26N3O3+ MolecularWeight: 308.39594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C2=COC=C2

Isomeric SMILES

CCC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C2=COC=C2

InChI

InChI=1S/C16H25N3O3/c1-4-16(2,3)17-14(20)11-18-6-8-19(9-7-18)15(21)13-5-10-22-12-13/h5,10,12H,4,6-9,11H2,1-3H3,(H,17,20)/p+1