2-(2-chloranyl-4,6-dimethyl-phenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]ethanamide

Systemtic Name: 2-(2-chloranyl-4,6-dimethyl-phenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]ethanamide Openeye Name: 2-(2-chloro-4,6-dimethyl-phenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide CAS Name: 2-(2-chloro-4,6-dimethylphenoxy)-N-[4-(1-piperidin-1-iumylmethyl)phenyl]acetamide IUPAC Name: 2-(2-chloro-4,6-dimethylphenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide Traditional Name: 2-(2-chloro-4,6-dimethyl-phenoxy)-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]acetamide Formula: C22H28ClN2O2+ MolecularWeight: 387.92292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)OCC(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)OCC(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3)C

InChI

InChI=1S/C22H27ClN2O2/c1-16-12-17(2)22(20(23)13-16)27-15-21(26)24-19-8-6-18(7-9-19)14-25-10-4-3-5-11-25/h6-9,12-13H,3-5,10-11,14-15H2,1-2H3,(H,24,26)/p+1