3-[4-azanyl-5,6-bis(furan-2-yl)furo[2,3-d]pyrimidin-3-ium-3-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[4-azanyl-5,6-bis(furan-2-yl)furo[2,3-d]pyrimidin-3-ium-3-yl]propyl-dimethyl-azanium Openeye Name: 3-[4-amino-5,6-bis(2-furyl)furo[2,3-d]pyrimidin-3-ium-3-yl]propyl-dimethyl-ammonium CAS Name: 3-[4-amino-5,6-bis(2-furanyl)-3-furo[2,3-d]pyrimidin-3-iumyl]propyl-dimethylammonium IUPAC Name: 3-[4-amino-5,6-bis(furan-2-yl)furo[2,3-d]pyrimidin-3-ium-3-yl]propyl-dimethylazanium Traditional Name: 3-[4-amino-5,6-bis(2-furyl)furo[2,3-d]pyrimidin-3-ium-3-yl]propyl-dimethyl-ammonium Formula: C19H22N4O3+2 MolecularWeight: 354.40298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[N+]1=C(C2=C(N=C1)OC(=C2C3=CC=CO3)C4=CC=CO4)N

Isomeric SMILES

C[NH+](C)CCC[N+]1=C(C2=C(N=C1)OC(=C2C3=CC=CO3)C4=CC=CO4)N

InChI

InChI=1S/C19H20N4O3/c1-22(2)8-5-9-23-12-21-19-16(18(23)20)15(13-6-3-10-24-13)17(26-19)14-7-4-11-25-14/h3-4,6-7,10-12,20H,5,8-9H2,1-2H3/p+2