bis(4-methylpentyl) 4-bromanylbenzene-1,2-dicarboxylate

Systemtic Name: bis(4-methylpentyl) 4-bromanylbenzene-1,2-dicarboxylate Openeye Name: diisohexyl 4-bromobenzene-1,2-dicarboxylate CAS Name: 4-bromobenzene-1,2-dicarboxylic acid bis(4-methylpentyl) ester IUPAC Name: bis(4-methylpentyl) 4-bromobenzene-1,2-dicarboxylate Traditional Name: 4-bromobenzene-1,2-dicarboxylic acid diisohexyl ester Formula: C20H29BrO4 MolecularWeight: 413.34586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(=O)C1=C(C=C(C=C1)Br)C(=O)OCCCC(C)C

Isomeric SMILES

CC(C)CCCOC(=O)C1=C(C=C(C=C1)Br)C(=O)OCCCC(C)C

InChI

InChI=1S/C20H29BrO4/c1-14(2)7-5-11-24-19(22)17-10-9-16(21)13-18(17)20(23)25-12-6-8-15(3)4/h9-10,13-15H,5-8,11-12H2,1-4H3