[4-(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperazin-4-ium-1-yl]-phenyl-methanone

Systemtic Name: [4-(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperazin-4-ium-1-yl]-phenyl-methanone Openeye Name: [4-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperazin-4-ium-1-yl]-phenyl-methanone CAS Name: [4-(2-ethyl-4-benzofuro[3,2-d]pyrimidinyl)-1-piperazin-4-iumyl]-phenylmethanone IUPAC Name: [4-(2-ethyl-[1]benzofuro[3,2-d]pyrimidin-4-yl)piperazin-4-ium-1-yl]-phenylmethanone Traditional Name: [4-(2-ethylbenzofuro[3,2-d]pyrimidin-4-yl)piperazin-4-ium-1-yl]-phenyl-methanone Formula: C23H23N4O2+ MolecularWeight: 387.45432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=N1)[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4)OC5=CC=CC=C52

Isomeric SMILES

CCC1=NC2=C(C(=N1)[NH+]3CCN(CC3)C(=O)C4=CC=CC=C4)OC5=CC=CC=C52

InChI

InChI=1S/C23H22N4O2/c1-2-19-24-20-17-10-6-7-11-18(17)29-21(20)22(25-19)26-12-14-27(15-13-26)23(28)16-8-4-3-5-9-16/h3-11H,2,12-15H2,1H3/p+1