ethyl 5-bromanyl-1-(3-methoxyphenyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-bromanyl-1-(3-methoxyphenyl)pyrazole-4-carboxylate Openeye Name: ethyl 5-bromo-1-(3-methoxyphenyl)pyrazole-4-carboxylate CAS Name: 5-bromo-1-(3-methoxyphenyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-1-(3-methoxyphenyl)pyrazole-4-carboxylate Traditional Name: 5-bromo-1-(3-methoxyphenyl)pyrazole-4-carboxylic acid ethyl ester Formula: C13H13BrN2O3 MolecularWeight: 325.15792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)OC)Br

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)OC)Br

InChI

InChI=1S/C13H13BrN2O3/c1-3-19-13(17)11-8-15-16(12(11)14)9-5-4-6-10(7-9)18-2/h4-8H,3H2,1-2H3