1-(4-butoxyphenyl)-5-(trifluoromethyl)-1,2,3,4-tetrazole

Systemtic Name: 1-(4-butoxyphenyl)-5-(trifluoromethyl)-1,2,3,4-tetrazole Openeye Name: 1-(4-butoxyphenyl)-5-(trifluoromethyl)tetrazole CAS Name: 1-(4-butoxyphenyl)-5-(trifluoromethyl)tetrazole IUPAC Name: 1-(4-butoxyphenyl)-5-(trifluoromethyl)tetrazole Traditional Name: 1-(4-butoxyphenyl)-5-(trifluoromethyl)tetrazole Formula: C12H13F3N4O MolecularWeight: 286.25303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N2C(=NN=N2)C(F)(F)F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N2C(=NN=N2)C(F)(F)F

InChI

InChI=1S/C12H13F3N4O/c1-2-3-8-20-10-6-4-9(5-7-10)19-11(12(13,14)15)16-17-18-19/h4-7H,2-3,8H2,1H3