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

Systemtic Name: 3-[4-azanyl-5,6-bis(4-methoxyphenyl)furo[2,3-d]pyrimidin-3-ium-3-yl]propyl-dimethyl-azanium Openeye Name: 3-[4-amino-5,6-bis(4-methoxyphenyl)furo[2,3-d]pyrimidin-3-ium-3-yl]propyl-dimethyl-ammonium CAS Name: 3-[4-amino-5,6-bis(4-methoxyphenyl)-3-furo[2,3-d]pyrimidin-3-iumyl]propyl-dimethylammonium IUPAC Name: 3-[4-amino-5,6-bis(4-methoxyphenyl)furo[2,3-d]pyrimidin-3-ium-3-yl]propyl-dimethylazanium Traditional Name: 3-[4-amino-5,6-bis(4-methoxyphenyl)furo[2,3-d]pyrimidin-3-ium-3-yl]propyl-dimethyl-ammonium Formula: C25H30N4O3+2 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCC[N+]1=C(C2=C(N=C1)OC(=C2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)N

Isomeric SMILES

C[NH+](C)CCC[N+]1=C(C2=C(N=C1)OC(=C2C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)N

InChI

InChI=1S/C25H28N4O3/c1-28(2)14-5-15-29-16-27-25-22(24(29)26)21(17-6-10-19(30-3)11-7-17)23(32-25)18-8-12-20(31-4)13-9-18/h6-13,16,26H,5,14-15H2,1-4H3/p+2