(2-ethylpyrazol-3-yl) 4-bromanyl-2-[(4-methyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)methyl]benzoate

Systemtic Name: (2-ethylpyrazol-3-yl) 4-bromanyl-2-[(4-methyl-5-oxidanylidene-1,2,3,4-tetrazol-1-yl)methyl]benzoate Openeye Name: (2-ethylpyrazol-3-yl) 4-bromo-2-[(4-methyl-5-oxo-tetrazol-1-yl)methyl]benzoate CAS Name: 4-bromo-2-[(4-methyl-5-oxo-1-tetrazolyl)methyl]benzoic acid (2-ethyl-3-pyrazolyl) ester IUPAC Name: (2-ethylpyrazol-3-yl) 4-bromo-2-[(4-methyl-5-oxotetrazol-1-yl)methyl]benzoate Traditional Name: 4-bromo-2-[(5-keto-4-methyl-tetrazol-1-yl)methyl]benzoic acid (2-ethylpyrazol-3-yl) ester Formula: C15H15BrN6O3 MolecularWeight: 407.222

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)OC(=O)C2=C(C=C(C=C2)Br)CN3C(=O)N(N=N3)C

Isomeric SMILES

CCN1C(=CC=N1)OC(=O)C2=C(C=C(C=C2)Br)CN3C(=O)N(N=N3)C

InChI

InChI=1S/C15H15BrN6O3/c1-3-21-13(6-7-17-21)25-14(23)12-5-4-11(16)8-10(12)9-22-15(24)20(2)18-19-22/h4-8H,3,9H2,1-2H3