4-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]-2-methyl-[1]benzofuro[3,2-d]pyrimidine

Systemtic Name: 4-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]-2-methyl-[1]benzofuro[3,2-d]pyrimidine Openeye Name: 4-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]-2-methyl-benzofuro[3,2-d]pyrimidine CAS Name: 4-[4-(2-methoxyphenyl)-1-piperazin-4-iumyl]-2-methylbenzofuro[3,2-d]pyrimidine IUPAC Name: 4-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]-2-methyl-[1]benzofuro[3,2-d]pyrimidine Traditional Name: 4-[4-(2-methoxyphenyl)piperazin-4-ium-1-yl]-2-methyl-benzofuro[3,2-d]pyrimidine Formula: C22H23N4O2+ MolecularWeight: 375.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N3CC[NH+](CC3)C4=CC=CC=C4OC)OC5=CC=CC=C52

Isomeric SMILES

CC1=NC2=C(C(=N1)N3CC[NH+](CC3)C4=CC=CC=C4OC)OC5=CC=CC=C52

InChI

InChI=1S/C22H22N4O2/c1-15-23-20-16-7-3-5-9-18(16)28-21(20)22(24-15)26-13-11-25(12-14-26)17-8-4-6-10-19(17)27-2/h3-10H,11-14H2,1-2H3/p+1