5-[(7-bromanyl-2,3-dimethyl-1-benzofuran-4-yl)methyl]-1H-1,2,4-triazole

Systemtic Name: 5-[(7-bromanyl-2,3-dimethyl-1-benzofuran-4-yl)methyl]-1H-1,2,4-triazole Openeye Name: 5-[(7-bromo-2,3-dimethyl-benzofuran-4-yl)methyl]-1H-1,2,4-triazole CAS Name: 5-[(7-bromo-2,3-dimethyl-4-benzofuranyl)methyl]-1H-1,2,4-triazole IUPAC Name: 5-[(7-bromo-2,3-dimethyl-1-benzofuran-4-yl)methyl]-1H-1,2,4-triazole Traditional Name: 5-[(7-bromo-2,3-dimethyl-benzofuran-4-yl)methyl]-1H-1,2,4-triazole Formula: C13H12BrN3O MolecularWeight: 306.15788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C=CC(=C12)CC3=NC=NN3)Br)C

Isomeric SMILES

CC1=C(OC2=C(C=CC(=C12)CC3=NC=NN3)Br)C

InChI

InChI=1S/C13H12BrN3O/c1-7-8(2)18-13-10(14)4-3-9(12(7)13)5-11-15-6-16-17-11/h3-4,6H,5H2,1-2H3,(H,15,16,17)