O1-butyl O2-(4-methylpentyl) 4-bromanyl-5-ethyl-benzene-1,2-dicarboxylate

Systemtic Name: O1-butyl O2-(4-methylpentyl) 4-bromanyl-5-ethyl-benzene-1,2-dicarboxylate Openeye Name: O1-butyl O2-isohexyl 4-bromo-5-ethyl-benzene-1,2-dicarboxylate CAS Name: 4-bromo-5-ethylbenzene-1,2-dicarboxylic acid O1-butyl ester O2-(4-methylpentyl) ester IUPAC Name: 1-O-butyl 2-O-(4-methylpentyl) 4-bromo-5-ethylbenzene-1,2-dicarboxylate Traditional Name: 4-bromo-5-ethyl-benzene-1,2-dicarboxylic acid O1-butyl ester O2-isohexyl ester Formula: C20H29BrO4 MolecularWeight: 413.34586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=C(C=C1C(=O)OCCCC(C)C)Br)CC

Isomeric SMILES

CCCCOC(=O)C1=CC(=C(C=C1C(=O)OCCCC(C)C)Br)CC

InChI

InChI=1S/C20H29BrO4/c1-5-7-10-24-19(22)16-12-15(6-2)18(21)13-17(16)20(23)25-11-8-9-14(3)4/h12-14H,5-11H2,1-4H3