6-ethyloctan-3-yl 2-bromanylbenzoate

Systemtic Name: 6-ethyloctan-3-yl 2-bromanylbenzoate Openeye Name: 1,4-diethylhexyl 2-bromobenzoate CAS Name: 2-bromobenzoic acid 6-ethyloctan-3-yl ester IUPAC Name: 6-ethyloctan-3-yl 2-bromobenzoate Traditional Name: 2-bromobenzoic acid 1,4-diethylhexyl ester Formula: C17H25BrO2 MolecularWeight: 341.2832

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CCC(CC)OC(=O)C1=CC=CC=C1Br

Isomeric SMILES

CCC(CC)CCC(CC)OC(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C17H25BrO2/c1-4-13(5-2)11-12-14(6-3)20-17(19)15-9-7-8-10-16(15)18/h7-10,13-14H,4-6,11-12H2,1-3H3