1-phenyl-2-(2-tridecyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)propan-2-ol chloride

Systemtic Name: 1-phenyl-2-(2-tridecyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)propan-2-ol chloride Openeye Name: 1-phenyl-2-(2-tridecyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)propan-2-ol chloride CAS Name: 1-phenyl-2-(2-tridecyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)-2-propanol chloride IUPAC Name: 1-phenyl-2-(2-tridecyl-4,5-dihydro-1H-imidazol-3-ium-3-yl)propan-2-ol chloride Traditional Name: 1-phenyl-2-(2-tridecyl-2-imidazolin-1-ium-1-yl)propan-2-ol chloride Formula: C25H43ClN2O MolecularWeight: 423.07472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=[N+](CCN1)C(C)(CC2=CC=CC=C2)O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCC1=[N+](CCN1)C(C)(CC2=CC=CC=C2)O.[Cl-]

InChI

InChI=1S/C25H42N2O.ClH/c1-3-4-5-6-7-8-9-10-11-12-16-19-24-26-20-21-27(24)25(2,28)22-23-17-14-13-15-18-23;/h13-15,17-18,28H,3-12,16,19-22H2,1-2H3;1H