2-hexadecyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium

Systemtic Name: 2-hexadecyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium Openeye Name: 2-hexadecyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium CAS Name: 2-hexadecyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium IUPAC Name: 2-hexadecyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium Traditional Name: 2-cetyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium Formula: C25H50N+ MolecularWeight: 364.6712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1(CC2CCCCC2C1)C

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1(CC2CCCCC2C1)C

InChI

InChI=1S/C25H50N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-26(2)22-24-19-16-17-20-25(24)23-26/h24-25H,3-23H2,1-2H3/q+1