1-[2-(4-cyclopentylphenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium

Systemtic Name: 1-[2-(4-cyclopentylphenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium Openeye Name: 1-[2-(4-cyclopentylphenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium CAS Name: 1-[2-(4-cyclopentylphenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium IUPAC Name: 1-[2-(4-cyclopentylphenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium Traditional Name: 1-[2-(4-cyclopentylphenyl)-2-(2-ethylhexoxy)ethyl]pyridin-1-ium Formula: C26H38NO+ MolecularWeight: 380.58602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(C[N+]1=CC=CC=C1)C2=CC=C(C=C2)C3CCCC3

Isomeric SMILES

CCCCC(CC)COC(C[N+]1=CC=CC=C1)C2=CC=C(C=C2)C3CCCC3

InChI

InChI=1S/C26H38NO/c1-3-5-11-22(4-2)21-28-26(20-27-18-9-6-10-19-27)25-16-14-24(15-17-25)23-12-7-8-13-23/h6,9-10,14-19,22-23,26H,3-5,7-8,11-13,20-21H2,1-2H3/q+1