methyl 3-bromanyl-4-(1,2,3,4-tetrazol-1-ylmethyl)benzoate

Systemtic Name: methyl 3-bromanyl-4-(1,2,3,4-tetrazol-1-ylmethyl)benzoate Openeye Name: methyl 3-bromo-4-(tetrazol-1-ylmethyl)benzoate CAS Name: 3-bromo-4-(1-tetrazolylmethyl)benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-(tetrazol-1-ylmethyl)benzoate Traditional Name: 3-bromo-4-(tetrazol-1-ylmethyl)benzoic acid methyl ester Formula: C10H9BrN4O2 MolecularWeight: 297.10806

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)CN2C=NN=N2)Br

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)CN2C=NN=N2)Br

InChI

InChI=1S/C10H9BrN4O2/c1-17-10(16)7-2-3-8(9(11)4-7)5-15-6-12-13-14-15/h2-4,6H,5H2,1H3