2-(azocan-1-ium-1-yl)-N-(2-chloranyl-4,6-dimethyl-phenyl)ethanamide

Systemtic Name: 2-(azocan-1-ium-1-yl)-N-(2-chloranyl-4,6-dimethyl-phenyl)ethanamide Openeye Name: 2-(azocan-1-ium-1-yl)-N-(2-chloro-4,6-dimethyl-phenyl)acetamide CAS Name: 2-(1-azocan-1-iumyl)-N-(2-chloro-4,6-dimethylphenyl)acetamide IUPAC Name: 2-(azocan-1-ium-1-yl)-N-(2-chloro-4,6-dimethylphenyl)acetamide Traditional Name: 2-(azocan-1-ium-1-yl)-N-(2-chloro-4,6-dimethyl-phenyl)acetamide Formula: C17H26ClN2O+ MolecularWeight: 309.85414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)C[NH+]2CCCCCCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)C[NH+]2CCCCCCC2)C

InChI

InChI=1S/C17H25ClN2O/c1-13-10-14(2)17(15(18)11-13)19-16(21)12-20-8-6-4-3-5-7-9-20/h10-11H,3-9,12H2,1-2H3,(H,19,21)/p+1