dimethyl 1-(4-bromanyl-2-ethyl-phenyl)pyrazole-3,4-dicarboxylate

Systemtic Name: dimethyl 1-(4-bromanyl-2-ethyl-phenyl)pyrazole-3,4-dicarboxylate Openeye Name: dimethyl 1-(4-bromo-2-ethyl-phenyl)pyrazole-3,4-dicarboxylate CAS Name: 1-(4-bromo-2-ethylphenyl)pyrazole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(4-bromo-2-ethylphenyl)pyrazole-3,4-dicarboxylate Traditional Name: 1-(4-bromo-2-ethyl-phenyl)pyrazole-3,4-dicarboxylic acid dimethyl ester Formula: C15H15BrN2O4 MolecularWeight: 367.1946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)N2C=C(C(=N2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)N2C=C(C(=N2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C15H15BrN2O4/c1-4-9-7-10(16)5-6-12(9)18-8-11(14(19)21-2)13(17-18)15(20)22-3/h5-8H,4H2,1-3H3