1-pyrrolidin-1-yl-2-[4-(2,4,5-trimethylfuran-3-yl)carbonylpiperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-pyrrolidin-1-yl-2-[4-(2,4,5-trimethylfuran-3-yl)carbonylpiperazin-1-ium-1-yl]ethanone Openeye Name: 1-pyrrolidin-1-yl-2-[4-(2,4,5-trimethylfuran-3-carbonyl)piperazin-1-ium-1-yl]ethanone CAS Name: 2-[4-[oxo-(2,4,5-trimethyl-3-furanyl)methyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 1-pyrrolidin-1-yl-2-[4-(2,4,5-trimethylfuran-3-carbonyl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-pyrrolidino-2-[4-(2,4,5-trimethyl-3-furoyl)piperazin-1-ium-1-yl]ethanone Formula: C18H28N3O3+ MolecularWeight: 334.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C(=O)N2CC[NH+](CC2)CC(=O)N3CCCC3)C)C

Isomeric SMILES

CC1=C(OC(=C1C(=O)N2CC[NH+](CC2)CC(=O)N3CCCC3)C)C

InChI

InChI=1S/C18H27N3O3/c1-13-14(2)24-15(3)17(13)18(23)21-10-8-19(9-11-21)12-16(22)20-6-4-5-7-20/h4-12H2,1-3H3/p+1