methyl 6-bromanyl-3-ethanoyl-cinnoline-4-carboxylate

Systemtic Name: methyl 6-bromanyl-3-ethanoyl-cinnoline-4-carboxylate Openeye Name: methyl 3-acetyl-6-bromo-cinnoline-4-carboxylate CAS Name: 3-acetyl-6-bromo-4-cinnolinecarboxylic acid methyl ester IUPAC Name: methyl 3-acetyl-6-bromocinnoline-4-carboxylate Traditional Name: 3-acetyl-6-bromo-cinnoline-4-carboxylic acid methyl ester Formula: C12H9BrN2O3 MolecularWeight: 309.11546

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN=C2C=CC(=CC2=C1C(=O)OC)Br

Isomeric SMILES

CC(=O)C1=NN=C2C=CC(=CC2=C1C(=O)OC)Br

InChI

InChI=1S/C12H9BrN2O3/c1-6(16)11-10(12(17)18-2)8-5-7(13)3-4-9(8)14-15-11/h3-5H,1-2H3