1-(naphthalen-1-ylmethyl)-N-[2,4,5-tris(chloranyl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(naphthalen-1-ylmethyl)-N-[2,4,5-tris(chloranyl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-(1-naphthylmethyl)-N-(2,4,5-trichlorophenyl)piperidin-1-ium-4-carboxamide CAS Name: 1-(1-naphthalenylmethyl)-N-(2,4,5-trichlorophenyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(naphthalen-1-ylmethyl)-N-(2,4,5-trichlorophenyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(1-naphthylmethyl)-N-(2,4,5-trichlorophenyl)piperidin-1-ium-4-carboxamide Formula: C23H22Cl3N2O+ MolecularWeight: 448.79258

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H21Cl3N2O/c24-19-12-21(26)22(13-20(19)25)27-23(29)16-8-10-28(11-9-16)14-17-6-3-5-15-4-1-2-7-18(15)17/h1-7,12-13,16H,8-11,14H2,(H,27,29)/p+1