(E)-2-(4,5-dihydro-1H-imidazol-3-ium-3-yl)henicos-12-en-6-ol

Systemtic Name: (E)-2-(4,5-dihydro-1H-imidazol-3-ium-3-yl)henicos-12-en-6-ol Openeye Name: (E)-2-(4,5-dihydro-1H-imidazol-3-ium-3-yl)henicos-12-en-6-ol CAS Name: (E)-2-(4,5-dihydro-1H-imidazol-3-ium-3-yl)-12-heneicosen-6-ol IUPAC Name: (E)-2-(4,5-dihydro-1H-imidazol-3-ium-3-yl)henicos-12-en-6-ol Traditional Name: (E)-2-(2-imidazolin-1-ium-1-yl)heneicos-12-en-6-ol Formula: C24H47N2O+ MolecularWeight: 379.64278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCC(CCCC(C)[N+]1=CNCC1)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCC(CCCC(C)[N+]1=CNCC1)O

InChI

InChI=1S/C24H46N2O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24(27)19-16-17-23(2)26-21-20-25-22-26/h10-11,22-24,27H,3-9,12-21H2,1-2H3/p+1/b11-10+