dodecyl-(1-iodanylprop-2-ynyl)-di(nonyl)azanium

Systemtic Name: dodecyl-(1-iodanylprop-2-ynyl)-di(nonyl)azanium Openeye Name: dodecyl-(1-iodoprop-2-ynyl)-di(nonyl)ammonium CAS Name: dodecyl-(1-iodoprop-2-ynyl)-di(nonyl)ammonium IUPAC Name: dodecyl-(1-iodoprop-2-ynyl)-di(nonyl)azanium Traditional Name: 1-iodoprop-2-ynyl-lauryl-di(nonyl)ammonium Formula: C33H65IN+ MolecularWeight: 602.78037

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](CCCCCCCCC)(CCCCCCCCC)C(C#C)I

Isomeric SMILES

CCCCCCCCCCCC[N+](CCCCCCCCC)(CCCCCCCCC)C(C#C)I

InChI

InChI=1S/C33H65IN/c1-5-9-12-15-18-19-20-23-26-29-32-35(33(34)8-4,30-27-24-21-16-13-10-6-2)31-28-25-22-17-14-11-7-3/h4,33H,5-7,9-32H2,1-3H3/q+1