2-(4-chloranyl-3-methyl-phenoxy)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]ethanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]acetamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-2-(4-chloro-3-methyl-phenoxy)acetamide Formula: C21H25Cl2N2O2+ MolecularWeight: 408.3414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H24Cl2N2O2/c1-15-12-19(6-7-20(15)23)27-14-21(26)24-18-8-10-25(11-9-18)13-16-2-4-17(22)5-3-16/h2-7,12,18H,8-11,13-14H2,1H3,(H,24,26)/p+1