(6-bromanylnaphthalen-2-yl) 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate

Systemtic Name: (6-bromanylnaphthalen-2-yl) 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate Openeye Name: (6-bromo-2-naphthyl) 5-chloro-1,3-dimethyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1,3-dimethyl-4-pyrazolecarboxylic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) 5-chloro-1,3-dimethylpyrazole-4-carboxylate Traditional Name: 5-chloro-1,3-dimethyl-pyrazole-4-carboxylic acid (6-bromo-2-naphthyl) ester Formula: C16H12BrClN2O2 MolecularWeight: 379.63568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OC2=CC3=C(C=C2)C=C(C=C3)Br)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)OC2=CC3=C(C=C2)C=C(C=C3)Br)Cl)C

InChI

InChI=1S/C16H12BrClN2O2/c1-9-14(15(18)20(2)19-9)16(21)22-13-6-4-10-7-12(17)5-3-11(10)8-13/h3-8H,1-2H3