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

Systemtic Name: 2-butyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium Openeye Name: 2-butyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium CAS Name: 2-butyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium IUPAC Name: 2-butyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium Traditional Name: 2-butyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium Formula: C13H26N+ MolecularWeight: 196.35224

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(CC2CCCCC2C1)C

Isomeric SMILES

CCCC[N+]1(CC2CCCCC2C1)C

InChI

InChI=1S/C13H26N/c1-3-4-9-14(2)10-12-7-5-6-8-13(12)11-14/h12-13H,3-11H2,1-2H3/q+1