1-[2-(3-chlorophenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium

Systemtic Name: 1-[2-(3-chlorophenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium Openeye Name: 1-[2-(3-chlorophenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium CAS Name: 1-[2-(3-chlorophenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium IUPAC Name: 1-[2-(3-chlorophenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium Traditional Name: 1-[2-(3-chlorophenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium Formula: C21H29ClNO+ MolecularWeight: 346.91406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(C[N+]1=CC=CC=C1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCC(CC)COC(C[N+]1=CC=CC=C1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C21H29ClNO/c1-3-5-10-18(4-2)17-24-21(16-23-13-7-6-8-14-23)19-11-9-12-20(22)15-19/h6-9,11-15,18,21H,3-5,10,16-17H2,1-2H3/q+1