tridecan-5-yl 3-bromanylbenzoate

Systemtic Name: tridecan-5-yl 3-bromanylbenzoate Openeye Name: 1-butylnonyl 3-bromobenzoate CAS Name: 3-bromobenzoic acid tridecan-5-yl ester IUPAC Name: tridecan-5-yl 3-bromobenzoate Traditional Name: 3-bromobenzoic acid 1-butylnonyl ester Formula: C20H31BrO2 MolecularWeight: 383.36294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCC)OC(=O)C1=CC(=CC=C1)Br

Isomeric SMILES

CCCCCCCCC(CCCC)OC(=O)C1=CC(=CC=C1)Br

InChI

InChI=1S/C20H31BrO2/c1-3-5-7-8-9-10-15-19(14-6-4-2)23-20(22)17-12-11-13-18(21)16-17/h11-13,16,19H,3-10,14-15H2,1-2H3