[3-[(2R)-1-(furan-2-ylcarbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [3-[(2R)-1-(furan-2-ylcarbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [3-[(1R)-2-(furan-2-carbonylamino)-1-methyl-ethoxy]phenyl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [3-[(2R)-1-[[2-furanyl(oxo)methyl]amino]propan-2-yl]oxyphenyl]methyl-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [3-[(2R)-1-(furan-2-carbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [3-[(1R)-2-(2-furoylamino)-1-methyl-ethoxy]benzyl]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C22H33N3O3+2 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC=CO1)OC2=CC=CC(=C2)C[NH+](C)C3CC[NH+](CC3)C

Isomeric SMILES

C[C@H](CNC(=O)C1=CC=CO1)OC2=CC=CC(=C2)C[NH+](C)C3CC[NH+](CC3)C

InChI

InChI=1S/C22H31N3O3/c1-17(15-23-22(26)21-8-5-13-27-21)28-20-7-4-6-18(14-20)16-25(3)19-9-11-24(2)12-10-19/h4-8,13-14,17,19H,9-12,15-16H2,1-3H3,(H,23,26)/p+2/t17-/m1/s1