3H-benzimidazol-1-ium-1-ylmethanol; 6-chloranyldodecane; chloride

Systemtic Name: 3H-benzimidazol-1-ium-1-ylmethanol; 6-chloranyldodecane; chloride Openeye Name: 3H-benzimidazol-1-ium-1-ylmethanol; 6-chlorododecane; chloride CAS Name: 3H-benzimidazol-1-ium-1-ylmethanol; 6-chlorododecane; chloride IUPAC Name: 3H-benzimidazol-1-ium-1-ylmethanol; 6-chlorododecane; chloride Traditional Name: 3H-benzimidazol-1-ium-1-ylmethanol; 6-chlorododecane; chloride Formula: C20H34Cl2N2O MolecularWeight: 389.40276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCC)Cl.C1=CC=C2C(=C1)NC=[N+]2CO.[Cl-]

Isomeric SMILES

CCCCCCC(CCCCC)Cl.C1=CC=C2C(=C1)NC=[N+]2CO.[Cl-]

InChI

InChI=1S/C12H25Cl.C8H8N2O.ClH/c1-3-5-7-9-11-12(13)10-8-6-4-2;11-6-10-5-9-7-3-1-2-4-8(7)10;/h12H,3-11H2,1-2H3;1-5,11H,6H2;1H