[3-[(2R)-1-(furan-2-ylcarbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(pyrazin-2-ylmethyl)azanium

Systemtic Name: [3-[(2R)-1-(furan-2-ylcarbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(pyrazin-2-ylmethyl)azanium Openeye Name: [3-[(1R)-2-(furan-2-carbonylamino)-1-methyl-ethoxy]phenyl]methyl-methyl-(pyrazin-2-ylmethyl)ammonium CAS Name: [3-[(2R)-1-[[2-furanyl(oxo)methyl]amino]propan-2-yl]oxyphenyl]methyl-methyl-(2-pyrazinylmethyl)ammonium IUPAC Name: [3-[(2R)-1-(furan-2-carbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(pyrazin-2-ylmethyl)azanium Traditional Name: [3-[(1R)-2-(2-furoylamino)-1-methyl-ethoxy]benzyl]-methyl-(pyrazin-2-ylmethyl)ammonium Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC=CO1)OC2=CC=CC(=C2)C[NH+](C)CC3=NC=CN=C3

Isomeric SMILES

C[C@H](CNC(=O)C1=CC=CO1)OC2=CC=CC(=C2)C[NH+](C)CC3=NC=CN=C3

InChI

InChI=1S/C21H24N4O3/c1-16(12-24-21(26)20-7-4-10-27-20)28-19-6-3-5-17(11-19)14-25(2)15-18-13-22-8-9-23-18/h3-11,13,16H,12,14-15H2,1-2H3,(H,24,26)/p+1/t16-/m1/s1