4-[3-bromanyl-4-(trifluoromethyl)phenyl]-N,N-diethyl-5-oxidanylidene-1,2,3,4-tetrazole-1-carboxamide

Systemtic Name: 4-[3-bromanyl-4-(trifluoromethyl)phenyl]-N,N-diethyl-5-oxidanylidene-1,2,3,4-tetrazole-1-carboxamide Openeye Name: 4-[3-bromo-4-(trifluoromethyl)phenyl]-N,N-diethyl-5-oxo-tetrazole-1-carboxamide CAS Name: 4-[3-bromo-4-(trifluoromethyl)phenyl]-N,N-diethyl-5-oxo-1-tetrazolecarboxamide IUPAC Name: 4-[3-bromo-4-(trifluoromethyl)phenyl]-N,N-diethyl-5-oxotetrazole-1-carboxamide Traditional Name: 4-[3-bromo-4-(trifluoromethyl)phenyl]-N,N-diethyl-5-keto-tetrazole-1-carboxamide Formula: C13H13BrF3N5O2 MolecularWeight: 408.17383

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1C(=O)N(N=N1)C2=CC(=C(C=C2)C(F)(F)F)Br

Isomeric SMILES

CCN(CC)C(=O)N1C(=O)N(N=N1)C2=CC(=C(C=C2)C(F)(F)F)Br

InChI

InChI=1S/C13H13BrF3N5O2/c1-3-20(4-2)11(23)22-12(24)21(18-19-22)8-5-6-9(10(14)7-8)13(15,16)17/h5-7H,3-4H2,1-2H3