5-[2-(6-bromanyl-1,3-benzodioxol-5-yl)propyl]-1H-imidazole

Systemtic Name: 5-[2-(6-bromanyl-1,3-benzodioxol-5-yl)propyl]-1H-imidazole Openeye Name: 5-[2-(6-bromo-1,3-benzodioxol-5-yl)propyl]-1H-imidazole CAS Name: 5-[2-(6-bromo-1,3-benzodioxol-5-yl)propyl]-1H-imidazole IUPAC Name: 5-[2-(6-bromo-1,3-benzodioxol-5-yl)propyl]-1H-imidazole Traditional Name: 5-[2-(6-bromo-1,3-benzodioxol-5-yl)propyl]-1H-imidazole Formula: C13H13BrN2O2 MolecularWeight: 309.15852

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CN=CN1)C2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC(CC1=CN=CN1)C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C13H13BrN2O2/c1-8(2-9-5-15-6-16-9)10-3-12-13(4-11(10)14)18-7-17-12/h3-6,8H,2,7H2,1H3,(H,15,16)