(2S)-2-pyridin-3-ylazepan-1-ium

Systemtic Name: (2S)-2-pyridin-3-ylazepan-1-ium Openeye Name: (2S)-2-(3-pyridyl)azepan-1-ium CAS Name: (2S)-2-(3-pyridinyl)azepan-1-ium IUPAC Name: (2S)-2-pyridin-3-ylazepan-1-ium Traditional Name: (2S)-2-(3-pyridyl)azepan-1-ium Formula: C11H17N2+ MolecularWeight: 177.26608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC([NH2+]CC1)C2=CN=CC=C2

Isomeric SMILES

C1CC[C@H]([NH2+]CC1)C2=CN=CC=C2

InChI

InChI=1S/C11H16N2/c1-2-6-11(13-8-3-1)10-5-4-7-12-9-10/h4-5,7,9,11,13H,1-3,6,8H2/p+1/t11-/m0/s1