1-(4-bromophenyl)-3-[5-(4-nitrophenyl)-1,2,3,4-tetrazol-2-yl]propan-1-one

Systemtic Name: 1-(4-bromophenyl)-3-[5-(4-nitrophenyl)-1,2,3,4-tetrazol-2-yl]propan-1-one Openeye Name: 1-(4-bromophenyl)-3-[5-(4-nitrophenyl)tetrazol-2-yl]propan-1-one CAS Name: 1-(4-bromophenyl)-3-[5-(4-nitrophenyl)-2-tetrazolyl]-1-propanone IUPAC Name: 1-(4-bromophenyl)-3-[5-(4-nitrophenyl)tetrazol-2-yl]propan-1-one Traditional Name: 1-(4-bromophenyl)-3-[5-(4-nitrophenyl)tetrazol-2-yl]propan-1-one Formula: C16H12BrN5O3 MolecularWeight: 402.20218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(N=N2)CCC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NN(N=N2)CCC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H12BrN5O3/c17-13-5-1-11(2-6-13)15(23)9-10-21-19-16(18-20-21)12-3-7-14(8-4-12)22(24)25/h1-8H,9-10H2