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

Systemtic Name: 4-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-[1]benzofuro[3,2-d]pyrimidine Openeye Name: 4-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-benzofuro[3,2-d]pyrimidine CAS Name: 4-(4-ethyl-1-piperazin-4-iumyl)-2-phenylbenzofuro[3,2-d]pyrimidine IUPAC Name: 4-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-[1]benzofuro[3,2-d]pyrimidine Traditional Name: 4-(4-ethylpiperazin-4-ium-1-yl)-2-phenyl-benzofuro[3,2-d]pyrimidine Formula: C22H23N4O+ MolecularWeight: 359.44422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O/c1-2-25-12-14-26(15-13-25)22-20-19(17-10-6-7-11-18(17)27-20)23-21(24-22)16-8-4-3-5-9-16/h3-11H,2,12-15H2,1H3/p+1