2-(azepan-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-mesityl-acetamide Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+]2CCCCCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C[NH+]2CCCCCC2)C

InChI

InChI=1S/C17H26N2O/c1-13-10-14(2)17(15(3)11-13)18-16(20)12-19-8-6-4-5-7-9-19/h10-11H,4-9,12H2,1-3H3,(H,18,20)/p+1