ethyl 2-[5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2,3,4-tetrazol-2-yl]ethanoate

Systemtic Name: ethyl 2-[5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-1,2,3,4-tetrazol-2-yl]ethanoate Openeye Name: ethyl 2-[5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]tetrazol-2-yl]acetate CAS Name: 2-[5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-2-tetrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]tetrazol-2-yl]acetate Traditional Name: 2-[5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]tetrazol-2-yl]acetic acid ethyl ester Formula: C11H15BrN6O2 MolecularWeight: 343.1798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1N=C(N=N1)CN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCOC(=O)CN1N=C(N=N1)CN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C11H15BrN6O2/c1-4-20-10(19)6-18-15-9(13-16-18)5-17-8(3)11(12)7(2)14-17/h4-6H2,1-3H3