tridecan-3-yl 5-bromanylpentanoate

Systemtic Name: tridecan-3-yl 5-bromanylpentanoate Openeye Name: 1-ethylundecyl 5-bromopentanoate CAS Name: 5-bromopentanoic acid tridecan-3-yl ester IUPAC Name: tridecan-3-yl 5-bromopentanoate Traditional Name: 5-bromovaleric acid 1-ethylundecyl ester Formula: C18H35BrO2 MolecularWeight: 363.3733

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CC)OC(=O)CCCCBr

Isomeric SMILES

CCCCCCCCCCC(CC)OC(=O)CCCCBr

InChI

InChI=1S/C18H35BrO2/c1-3-5-6-7-8-9-10-11-14-17(4-2)21-18(20)15-12-13-16-19/h17H,3-16H2,1-2H3