ethyl 3-[3,5-bis(4-bromophenyl)-4-methyl-pyrazol-1-yl]propanoate

Systemtic Name: ethyl 3-[3,5-bis(4-bromophenyl)-4-methyl-pyrazol-1-yl]propanoate Openeye Name: ethyl 3-[3,5-bis(4-bromophenyl)-4-methyl-pyrazol-1-yl]propanoate CAS Name: 3-[3,5-bis(4-bromophenyl)-4-methyl-1-pyrazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3,5-bis(4-bromophenyl)-4-methylpyrazol-1-yl]propanoate Traditional Name: 3-[3,5-bis(4-bromophenyl)-4-methyl-pyrazol-1-yl]propionic acid ethyl ester Formula: C21H20Br2N2O2 MolecularWeight: 492.2037

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C(=C(C(=N1)C2=CC=C(C=C2)Br)C)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)CCN1C(=C(C(=N1)C2=CC=C(C=C2)Br)C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H20Br2N2O2/c1-3-27-19(26)12-13-25-21(16-6-10-18(23)11-7-16)14(2)20(24-25)15-4-8-17(22)9-5-15/h4-11H,3,12-13H2,1-2H3