cyclopentyl 2-(furan-2-ylcarbonylamino)-2-[1-(5-methylpyridin-2-yl)piperidin-1-ium-1-yl]butanoate

Systemtic Name: cyclopentyl 2-(furan-2-ylcarbonylamino)-2-[1-(5-methylpyridin-2-yl)piperidin-1-ium-1-yl]butanoate Openeye Name: cyclopentyl 2-(furan-2-carbonylamino)-2-[1-(5-methyl-2-pyridyl)piperidin-1-ium-1-yl]butanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-2-[1-(5-methyl-2-pyridinyl)-1-piperidin-1-iumyl]butanoic acid cyclopentyl ester IUPAC Name: cyclopentyl 2-(furan-2-carbonylamino)-2-[1-(5-methylpyridin-2-yl)piperidin-1-ium-1-yl]butanoate Traditional Name: 2-(2-furoylamino)-2-[1-(5-methyl-2-pyridyl)piperidin-1-ium-1-yl]butyric acid cyclopentyl ester Formula: C25H34N3O4+ MolecularWeight: 440.55516

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1CCCC1)(NC(=O)C2=CC=CO2)[N+]3(CCCCC3)C4=NC=C(C=C4)C

Isomeric SMILES

CCC(C(=O)OC1CCCC1)(NC(=O)C2=CC=CO2)[N+]3(CCCCC3)C4=NC=C(C=C4)C

InChI

InChI=1S/C25H33N3O4/c1-3-25(24(30)32-20-10-5-6-11-20,27-23(29)21-12-9-17-31-21)28(15-7-4-8-16-28)22-14-13-19(2)18-26-22/h9,12-14,17-18,20H,3-8,10-11,15-16H2,1-2H3/p+1