[3-(methoxymethyl)-1-benzofuran-2-yl]-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: [3-(methoxymethyl)-1-benzofuran-2-yl]-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: [3-(methoxymethyl)benzofuran-2-yl]-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [3-(methoxymethyl)-2-benzofuranyl]-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: [3-(methoxymethyl)-1-benzofuran-2-yl]-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: [3-(methoxymethyl)benzofuran-2-yl]-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C23H27N2O3+ MolecularWeight: 379.47208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4O3)COC

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4O3)COC

InChI

InChI=1S/C23H26N2O3/c1-17-7-3-4-8-18(17)15-24-11-13-25(14-12-24)23(26)22-20(16-27-2)19-9-5-6-10-21(19)28-22/h3-10H,11-16H2,1-2H3/p+1