(4-bromophenyl)methyl 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: (4-bromophenyl)methyl 2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: (4-bromophenyl)methyl 2-(5-phenyltetrazol-2-yl)acetate CAS Name: 2-(5-phenyl-2-tetrazolyl)acetic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-(5-phenyltetrazol-2-yl)acetate Traditional Name: 2-(5-phenyltetrazol-2-yl)acetic acid (4-bromobenzyl) ester Formula: C16H13BrN4O2 MolecularWeight: 373.20402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)OCC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N=N2)CC(=O)OCC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H13BrN4O2/c17-14-8-6-12(7-9-14)11-23-15(22)10-21-19-16(18-20-21)13-4-2-1-3-5-13/h1-9H,10-11H2