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

Systemtic Name: O1-ethyl O2-(2-methylpropyl) 4-bromanyl-5-ethyl-benzene-1,2-dicarboxylate Openeye Name: O1-ethyl O2-isobutyl 4-bromo-5-ethyl-benzene-1,2-dicarboxylate CAS Name: 4-bromo-5-ethylbenzene-1,2-dicarboxylic acid O1-ethyl ester O2-(2-methylpropyl) ester IUPAC Name: 1-O-ethyl 2-O-(2-methylpropyl) 4-bromo-5-ethylbenzene-1,2-dicarboxylate Traditional Name: 4-bromo-5-ethyl-benzene-1,2-dicarboxylic acid O1-ethyl ester O2-isobutyl ester Formula: C16H21BrO4 MolecularWeight: 357.23954

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C(=O)OCC)C(=O)OCC(C)C)Br

Isomeric SMILES

CCC1=C(C=C(C(=C1)C(=O)OCC)C(=O)OCC(C)C)Br

InChI

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