[4-[[6-(furan-2-ylmethylamino)pyridin-3-yl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[6-(furan-2-ylmethylamino)pyridin-3-yl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[[6-(2-furylmethylamino)-3-pyridyl]amino]-4-oxo-butyl]ammonium CAS Name: [4-[[6-(2-furanylmethylamino)-3-pyridinyl]amino]-4-oxobutyl]ammonium IUPAC Name: [4-[[6-(furan-2-ylmethylamino)pyridin-3-yl]amino]-4-oxobutyl]azanium Traditional Name: [4-[[6-(2-furfurylamino)-3-pyridyl]amino]-4-keto-butyl]ammonium Formula: C14H19N4O2+ MolecularWeight: 275.32626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC2=NC=C(C=C2)NC(=O)CCC[NH3+]

Isomeric SMILES

C1=COC(=C1)CNC2=NC=C(C=C2)NC(=O)CCC[NH3+]

InChI

InChI=1S/C14H18N4O2/c15-7-1-4-14(19)18-11-5-6-13(16-9-11)17-10-12-3-2-8-20-12/h2-3,5-6,8-9H,1,4,7,10,15H2,(H,16,17)(H,18,19)/p+1