1-methyl-4-tritriacontyl-pyridin-1-ium chloride

Systemtic Name: 1-methyl-4-tritriacontyl-pyridin-1-ium chloride Openeye Name: 1-methyl-4-tritriacontyl-pyridin-1-ium chloride CAS Name: 1-methyl-4-tritriacontylpyridin-1-ium chloride IUPAC Name: 1-methyl-4-tritriacontylpyridin-1-ium chloride Traditional Name: 1-methyl-4-tritriacontyl-pyridin-1-ium chloride Formula: C39H74ClN MolecularWeight: 592.46456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1=CC=[N+](C=C1)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC1=CC=[N+](C=C1)C.[Cl-]

InChI

InChI=1S/C39H74N.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-39-35-37-40(2)38-36-39;/h35-38H,3-34H2,1-2H3;1H/q+1;/p-1