[(1R)-1-(1-benzofuran-2-yl)-2-(2-oxidanylideneazepan-1-yl)ethyl]azanium

Systemtic Name: [(1R)-1-(1-benzofuran-2-yl)-2-(2-oxidanylideneazepan-1-yl)ethyl]azanium Openeye Name: [(1R)-1-(benzofuran-2-yl)-2-(2-oxoazepan-1-yl)ethyl]ammonium CAS Name: [(1R)-1-(2-benzofuranyl)-2-(2-oxo-1-azepanyl)ethyl]ammonium IUPAC Name: [(1R)-1-(1-benzofuran-2-yl)-2-(2-oxoazepan-1-yl)ethyl]azanium Traditional Name: [(1R)-1-(benzofuran-2-yl)-2-(2-ketoazepan-1-yl)ethyl]ammonium Formula: C16H21N2O2+ MolecularWeight: 273.35014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(C2=CC3=CC=CC=C3O2)[NH3+]

Isomeric SMILES

C1CCC(=O)N(CC1)C[C@H](C2=CC3=CC=CC=C3O2)[NH3+]

InChI

InChI=1S/C16H20N2O2/c17-13(11-18-9-5-1-2-8-16(18)19)15-10-12-6-3-4-7-14(12)20-15/h3-4,6-7,10,13H,1-2,5,8-9,11,17H2/p+1/t13-/m1/s1