1-benzofuran-2-yl-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: 1-benzofuran-2-yl-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Openeye Name: benzofuran-2-yl-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone CAS Name: 2-benzofuranyl-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: 1-benzofuran-2-yl-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Traditional Name: benzofuran-2-yl-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Formula: C21H23N2O3+ MolecularWeight: 351.41892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H22N2O3/c24-21(20-16-17-6-4-5-9-19(17)26-20)23-12-10-22(11-13-23)14-15-25-18-7-2-1-3-8-18/h1-9,16H,10-15H2/p+1