4-(3-fluoranyl-5-phenyl-2H-1,2,3,4-tetrazol-1-yl)-3-methyl-butan-2-one

Systemtic Name: 4-(3-fluoranyl-5-phenyl-2H-1,2,3,4-tetrazol-1-yl)-3-methyl-butan-2-one Openeye Name: 4-(3-fluoro-5-phenyl-2H-tetrazol-1-yl)-3-methyl-butan-2-one CAS Name: 4-(3-fluoro-5-phenyl-2H-tetrazol-1-yl)-3-methyl-2-butanone IUPAC Name: 4-(3-fluoro-5-phenyl-2H-tetrazol-1-yl)-3-methylbutan-2-one Traditional Name: 4-(3-fluoro-5-phenyl-2H-tetrazol-1-yl)-3-methyl-butan-2-one Formula: C12H15FN4O MolecularWeight: 250.272103

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=NN(N1)F)C2=CC=CC=C2)C(=O)C

Isomeric SMILES

CC(CN1C(=NN(N1)F)C2=CC=CC=C2)C(=O)C

InChI

InChI=1S/C12H15FN4O/c1-9(10(2)18)8-16-12(14-17(13)15-16)11-6-4-3-5-7-11/h3-7,9,15H,8H2,1-2H3