4-octadecyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-9-ium

Systemtic Name: 4-octadecyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-9-ium Openeye Name: 4-octadecyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-9-ium CAS Name: 4-octadecyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-9-ium IUPAC Name: 4-octadecyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-9-ium Traditional Name: 4-stearyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-9-ium Formula: C28H47N2+ MolecularWeight: 411.68618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1C2=[N+](CCC2)C3=CC=CC=C31

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1C2=[N+](CCC2)C3=CC=CC=C31

InChI

InChI=1S/C28H47N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24-29-26-21-17-18-22-27(26)30-25-20-23-28(29)30/h17-18,21-22H,2-16,19-20,23-25H2,1H3/q+1