[(3S)-2-oxidanylidene-1-phenyl-azepan-3-yl]azanium

Systemtic Name: [(3S)-2-oxidanylidene-1-phenyl-azepan-3-yl]azanium Openeye Name: [(3S)-2-oxo-1-phenyl-azepan-3-yl]ammonium CAS Name: [(3S)-2-oxo-1-phenyl-3-azepanyl]ammonium IUPAC Name: [(3S)-2-oxo-1-phenylazepan-3-yl]azanium Traditional Name: [(3S)-2-keto-1-phenyl-azepan-3-yl]ammonium Formula: C12H17N2O+ MolecularWeight: 205.27618

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)[NH3+])C2=CC=CC=C2

Isomeric SMILES

C1CCN(C(=O)[C@H](C1)[NH3+])C2=CC=CC=C2

InChI

InChI=1S/C12H16N2O/c13-11-8-4-5-9-14(12(11)15)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9,13H2/p+1/t11-/m0/s1