1-(1-chloranylpentan-3-yl)-2,4,6-triphenyl-pyridin-1-ium perchlorate

Systemtic Name: 1-(1-chloranylpentan-3-yl)-2,4,6-triphenyl-pyridin-1-ium perchlorate Openeye Name: 1-(3-chloro-1-ethyl-propyl)-2,4,6-triphenyl-pyridin-1-ium perchlorate CAS Name: 1-(1-chloropentan-3-yl)-2,4,6-triphenylpyridin-1-ium perchlorate IUPAC Name: 1-(1-chloropentan-3-yl)-2,4,6-triphenylpyridin-1-ium perchlorate Traditional Name: 1-(3-chloro-1-ethyl-propyl)-2,4,6-triphenyl-pyridin-1-ium perchlorate Formula: C28H27Cl2NO4 MolecularWeight: 512.42428

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCl)[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCC(CCCl)[N+]1=C(C=C(C=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C28H27ClN.ClHO4/c1-2-26(18-19-29)30-27(23-14-8-4-9-15-23)20-25(22-12-6-3-7-13-22)21-28(30)24-16-10-5-11-17-24;2-1(3,4)5/h3-17,20-21,26H,2,18-19H2,1H3;(H,2,3,4,5)/q+1;/p-1