8-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-ium-1-yl]methyl]quinoline

Systemtic Name: 8-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-ium-1-yl]methyl]quinoline Openeye Name: 8-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-ium-1-yl]methyl]quinoline CAS Name: 8-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazin-1-iumyl]methyl]quinoline IUPAC Name: 8-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-ium-1-yl]methyl]quinoline Traditional Name: 8-[[4-(coumaran-5-ylmethyl)piperazin-1-ium-1-yl]methyl]quinoline Formula: C23H26N3O+ MolecularWeight: 360.47204

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CC[NH+](CC3)CC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CC[NH+](CC3)CC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C23H25N3O/c1-3-19-5-2-9-24-23(19)21(4-1)17-26-12-10-25(11-13-26)16-18-6-7-22-20(15-18)8-14-27-22/h1-7,9,15H,8,10-14,16-17H2/p+1