1-phenyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-phenyl-4-[[3-(trifluoromethyl)phenyl]methyl]-1,2,3,4-tetrazol-5-one Openeye Name: 1-phenyl-4-[[3-(trifluoromethyl)phenyl]methyl]tetrazol-5-one CAS Name: 1-phenyl-4-[[3-(trifluoromethyl)phenyl]methyl]-5-tetrazolone IUPAC Name: 1-phenyl-4-[[3-(trifluoromethyl)phenyl]methyl]tetrazol-5-one Traditional Name: 1-phenyl-4-[3-(trifluoromethyl)benzyl]tetrazol-5-one Formula: C15H11F3N4O MolecularWeight: 320.26925

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)N(N=N2)CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)N(N=N2)CC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C15H11F3N4O/c16-15(17,18)12-6-4-5-11(9-12)10-21-14(23)22(20-19-21)13-7-2-1-3-8-13/h1-9H,10H2