4-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 4-[(7-chloranyl-1,3-benzodioxol-5-yl)methyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 4-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,2,4-triazole-3-carbonitrile CAS Name: 4-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 4-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 4-[(7-chloro-1,3-benzodioxol-5-yl)methyl]-1,2,4-triazole-3-carbonitrile Formula: C11H7ClN4O2 MolecularWeight: 262.65188

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)CN3C=NN=C3C#N)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)CN3C=NN=C3C#N)Cl

InChI

InChI=1S/C11H7ClN4O2/c12-8-1-7(2-9-11(8)18-6-17-9)4-16-5-14-15-10(16)3-13/h1-2,5H,4,6H2