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1-[(4S)-4-methylpentadecyl]pyridin-1-ium iodide

1-[(4S)-4-methylpentadecyl]pyridin-1-ium iodide

Systemtic Name:1-[(4S)-4-methylpentadecyl]pyridin-1-ium iodide
Openeye Name:1-[(4S)-4-methylpentadecyl]pyridin-1-ium iodide
CAS Name:1-[(4S)-4-methylpentadecyl]pyridin-1-ium iodide
IUPAC Name:1-[(4S)-4-methylpentadecyl]pyridin-1-ium iodide
Traditional Name:1-[(4S)-4-methylpentadecyl]pyridin-1-ium iodide
Formula: C21H38IN
MolecularWeight: 431.43759
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C)CCC[N+]1=CC=CC=C1.[I-]


Isomeric SMILES

CCCCCCCCCCC[C@H](C)CCC[N+]1=CC=CC=C1.[I-]


InChI

InChI=1S/C21H38N.HI/c1-3-4-5-6-7-8-9-10-12-16-21(2)17-15-20-22-18-13-11-14-19-22;/h11,13-14,18-19,21H,3-10,12,15-17,20H2,1-2H3;1H/q+1;/p-1/t21-;/m0./s1


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