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

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl)methyl 3-bromanylbenzoate Openeye Name: (1-phenyltetrazol-5-yl)methyl 3-bromobenzoate CAS Name: 3-bromobenzoic acid (1-phenyl-5-tetrazolyl)methyl ester IUPAC Name: (1-phenyltetrazol-5-yl)methyl 3-bromobenzoate Traditional Name: 3-bromobenzoic acid (1-phenyltetrazol-5-yl)methyl ester Formula: C15H11BrN4O2 MolecularWeight: 359.17744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)COC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)COC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C15H11BrN4O2/c16-12-6-4-5-11(9-12)15(21)22-10-14-17-18-19-20(14)13-7-2-1-3-8-13/h1-9H,10H2