diethyl 2-(4-bromophenyl)carbonyl-6-butoxy-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-(4-bromophenyl)carbonyl-6-butoxy-pyridine-3,5-dicarboxylate Openeye Name: diethyl 2-(4-bromobenzoyl)-6-butoxy-pyridine-3,5-dicarboxylate CAS Name: 2-[(4-bromophenyl)-oxomethyl]-6-butoxypyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(4-bromobenzoyl)-6-butoxypyridine-3,5-dicarboxylate Traditional Name: 2-(4-bromobenzoyl)-6-butoxy-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C22H24BrNO6 MolecularWeight: 478.33306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C(=N1)C(=O)C2=CC=C(C=C2)Br)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C(=N1)C(=O)C2=CC=C(C=C2)Br)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C22H24BrNO6/c1-4-7-12-30-20-17(22(27)29-6-3)13-16(21(26)28-5-2)18(24-20)19(25)14-8-10-15(23)11-9-14/h8-11,13H,4-7,12H2,1-3H3