dibutyl 4-bromanylbenzene-1,2-dicarboxylate

Systemtic Name: dibutyl 4-bromanylbenzene-1,2-dicarboxylate Openeye Name: dibutyl 4-bromobenzene-1,2-dicarboxylate CAS Name: 4-bromobenzene-1,2-dicarboxylic acid dibutyl ester IUPAC Name: dibutyl 4-bromobenzene-1,2-dicarboxylate Traditional Name: 4-bromobenzene-1,2-dicarboxylic acid dibutyl ester Formula: C16H21BrO4 MolecularWeight: 357.23954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C=C(C=C1)Br)C(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)C1=C(C=C(C=C1)Br)C(=O)OCCCC

InChI

InChI=1S/C16H21BrO4/c1-3-5-9-20-15(18)13-8-7-12(17)11-14(13)16(19)21-10-6-4-2/h7-8,11H,3-6,9-10H2,1-2H3