1-(4-fluorophenyl)-4-(5-pyridin-3-yl-1,2,3,4-tetrazol-2-yl)butan-1-one

Systemtic Name: 1-(4-fluorophenyl)-4-(5-pyridin-3-yl-1,2,3,4-tetrazol-2-yl)butan-1-one Openeye Name: 1-(4-fluorophenyl)-4-[5-(3-pyridyl)tetrazol-2-yl]butan-1-one CAS Name: 1-(4-fluorophenyl)-4-[5-(3-pyridinyl)-2-tetrazolyl]-1-butanone IUPAC Name: 1-(4-fluorophenyl)-4-(5-pyridin-3-yltetrazol-2-yl)butan-1-one Traditional Name: 1-(4-fluorophenyl)-4-[5-(3-pyridyl)tetrazol-2-yl]butan-1-one Formula: C16H14FN5O MolecularWeight: 311.313663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN(N=N2)CCCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CN=C1)C2=NN(N=N2)CCCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H14FN5O/c17-14-7-5-12(6-8-14)15(23)4-2-10-22-20-16(19-21-22)13-3-1-9-18-11-13/h1,3,5-9,11H,2,4,10H2