1-butyl-2-heptyl-3-(phenylmethyl)-2H-imidazole chloride

Systemtic Name: 1-butyl-2-heptyl-3-(phenylmethyl)-2H-imidazole chloride Openeye Name: 1-benzyl-3-butyl-2-heptyl-2H-imidazole chloride CAS Name: 1-butyl-2-heptyl-3-(phenylmethyl)-2H-imidazole chloride IUPAC Name: 1-benzyl-3-butyl-2-heptyl-2H-imidazole chloride Traditional Name: 1-benzyl-3-butyl-2-heptyl-4-imidazoline chloride Formula: C21H34ClN2- MolecularWeight: 349.96106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1N(C=CN1CC2=CC=CC=C2)CCCC.[Cl-]

Isomeric SMILES

CCCCCCCC1N(C=CN1CC2=CC=CC=C2)CCCC.[Cl-]

InChI

InChI=1S/C21H34N2.ClH/c1-3-5-7-8-12-15-21-22(16-6-4-2)17-18-23(21)19-20-13-10-9-11-14-20;/h9-11,13-14,17-18,21H,3-8,12,15-16,19H2,1-2H3;1H/p-1