2-(azepan-1-ium-1-yl)-N-[(2R)-2-cyano-3-methyl-butan-2-yl]ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-[(2R)-2-cyano-3-methyl-butan-2-yl]ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-[(1R)-1-cyano-1,2-dimethyl-propyl]acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-[(2R)-2-cyano-3-methylbutan-2-yl]acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-[(2R)-2-cyano-3-methylbutan-2-yl]acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-[(1R)-1-cyano-1,2-dimethyl-propyl]acetamide Formula: C14H26N3O+ MolecularWeight: 252.37574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C[NH+]1CCCCCC1

Isomeric SMILES

CC(C)[C@](C)(C#N)NC(=O)C[NH+]1CCCCCC1

InChI

InChI=1S/C14H25N3O/c1-12(2)14(3,11-15)16-13(18)10-17-8-6-4-5-7-9-17/h12H,4-10H2,1-3H3,(H,16,18)/p+1/t14-/m0/s1