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

Systemtic Name: ethyl 3-[3,5-bis(3-bromophenyl)-4-chloranyl-pyrazol-1-yl]propanoate Openeye Name: ethyl 3-[3,5-bis(3-bromophenyl)-4-chloro-pyrazol-1-yl]propanoate CAS Name: 3-[3,5-bis(3-bromophenyl)-4-chloro-1-pyrazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3,5-bis(3-bromophenyl)-4-chloropyrazol-1-yl]propanoate Traditional Name: 3-[3,5-bis(3-bromophenyl)-4-chloro-pyrazol-1-yl]propionic acid ethyl ester Formula: C20H17Br2ClN2O2 MolecularWeight: 512.62218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17Br2ClN2O2/c1-2-27-17(26)9-10-25-20(14-6-4-8-16(22)12-14)18(23)19(24-25)13-5-3-7-15(21)11-13/h3-8,11-12H,2,9-10H2,1H3