[(2S)-2-(azepan-1-yl)-2-(5-bromanylfuran-2-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(azepan-1-yl)-2-(5-bromanylfuran-2-yl)ethyl]azanium Openeye Name: [(2S)-2-(azepan-1-yl)-2-(5-bromo-2-furyl)ethyl]ammonium CAS Name: [(2S)-2-(1-azepanyl)-2-(5-bromo-2-furanyl)ethyl]ammonium IUPAC Name: [(2S)-2-(azepan-1-yl)-2-(5-bromofuran-2-yl)ethyl]azanium Traditional Name: [(2S)-2-(azepan-1-yl)-2-(5-bromo-2-furyl)ethyl]ammonium Formula: C12H20BrN2O+ MolecularWeight: 288.204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(C[NH3+])C2=CC=C(O2)Br

Isomeric SMILES

C1CCCN(CC1)[C@@H](C[NH3+])C2=CC=C(O2)Br

InChI

InChI=1S/C12H19BrN2O/c13-12-6-5-11(16-12)10(9-14)15-7-3-1-2-4-8-15/h5-6,10H,1-4,7-9,14H2/p+1/t10-/m0/s1