1-(3-iodanyl-4-methoxy-phenyl)-5-(trifluoromethyl)-1,2,3,4-tetrazole

Systemtic Name: 1-(3-iodanyl-4-methoxy-phenyl)-5-(trifluoromethyl)-1,2,3,4-tetrazole Openeye Name: 1-(3-iodo-4-methoxy-phenyl)-5-(trifluoromethyl)tetrazole CAS Name: 1-(3-iodo-4-methoxyphenyl)-5-(trifluoromethyl)tetrazole IUPAC Name: 1-(3-iodo-4-methoxyphenyl)-5-(trifluoromethyl)tetrazole Traditional Name: 1-(3-iodo-4-methoxy-phenyl)-5-(trifluoromethyl)tetrazole Formula: C9H6F3IN4O MolecularWeight: 370.06982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=NN=N2)C(F)(F)F)I

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=NN=N2)C(F)(F)F)I

InChI

InChI=1S/C9H6F3IN4O/c1-18-7-3-2-5(4-6(7)13)17-8(9(10,11)12)14-15-16-17/h2-4H,1H3