[(1R)-1-(1-benzofuran-2-yl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(1R)-1-(1-benzofuran-2-yl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]azanium Openeye Name: [(1R)-1-(benzofuran-2-yl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]ammonium CAS Name: [(1R)-1-(2-benzofuranyl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]ammonium IUPAC Name: [(1R)-1-(1-benzofuran-2-yl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]azanium Traditional Name: [(1R)-1-(benzofuran-2-yl)-2-(4-methyl-1,4-diazepan-4-ium-1-yl)ethyl]ammonium Formula: C16H25N3O+2 MolecularWeight: 275.3892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O/c1-18-7-4-8-19(10-9-18)12-14(17)16-11-13-5-2-3-6-15(13)20-16/h2-3,5-6,11,14H,4,7-10,12,17H2,1H3/p+2/t14-/m1/s1