tridecyl 2-bromanylbenzoate

Systemtic Name: tridecyl 2-bromanylbenzoate Openeye Name: tridecyl 2-bromobenzoate CAS Name: 2-bromobenzoic acid tridecyl ester IUPAC Name: tridecyl 2-bromobenzoate Traditional Name: 2-bromobenzoic acid tridecyl ester Formula: C20H31BrO2 MolecularWeight: 383.36294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1Br

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C20H31BrO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-23-20(22)18-15-12-13-16-19(18)21/h12-13,15-16H,2-11,14,17H2,1H3