[(1S)-1-(1-benzofuran-2-yl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(1S)-1-(1-benzofuran-2-yl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium Openeye Name: [(1S)-1-(benzofuran-2-yl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]ammonium CAS Name: [(1S)-1-(2-benzofuranyl)-2-(4-methyl-1-piperazin-4-iumyl)ethyl]ammonium IUPAC Name: [(1S)-1-(1-benzofuran-2-yl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium Traditional Name: [(1S)-1-(benzofuran-2-yl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C15H23N3O+2 MolecularWeight: 261.36262

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CC(C2=CC3=CC=CC=C3O2)[NH3+]

Isomeric SMILES

C[NH+]1CCN(CC1)C[C@@H](C2=CC3=CC=CC=C3O2)[NH3+]

InChI

InChI=1S/C15H21N3O/c1-17-6-8-18(9-7-17)11-13(16)15-10-12-4-2-3-5-14(12)19-15/h2-5,10,13H,6-9,11,16H2,1H3/p+2/t13-/m0/s1