4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-[1]benzofuro[3,2-d]pyrimidine

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-[1]benzofuro[3,2-d]pyrimidine Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-benzofuro[3,2-d]pyrimidine CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-2-phenylbenzofuro[3,2-d]pyrimidine IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-[1]benzofuro[3,2-d]pyrimidine Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-benzofuro[3,2-d]pyrimidine Formula: C21H21N4O+ MolecularWeight: 345.41764

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=NC3=C2OC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=NC3=C2OC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C21H20N4O/c1-24-11-13-25(14-12-24)21-19-18(16-9-5-6-10-17(16)26-19)22-20(23-21)15-7-3-2-4-8-15/h2-10H,11-14H2,1H3/p+1