5,7-bis(iodanyl)-4-pentoxy-2H-benzotriazole

Systemtic Name: 5,7-bis(iodanyl)-4-pentoxy-2H-benzotriazole Openeye Name: 5,7-diiodo-4-pentoxy-2H-benzotriazole CAS Name: 5,7-diiodo-4-pentoxy-2H-benzotriazole IUPAC Name: 5,7-diiodo-4-pentoxy-2H-benzotriazole Traditional Name: 4-amoxy-5,7-diiodo-2H-benzotriazole Formula: C11H13I2N3O MolecularWeight: 457.04936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C2=NNN=C12)I)I

Isomeric SMILES

CCCCCOC1=C(C=C(C2=NNN=C12)I)I

InChI

InChI=1S/C11H13I2N3O/c1-2-3-4-5-17-11-8(13)6-7(12)9-10(11)15-16-14-9/h6H,2-5H2,1H3,(H,14,15,16)