pentadecan-4-yl 2-bromanylbenzoate

Systemtic Name: pentadecan-4-yl 2-bromanylbenzoate Openeye Name: 1-propyldodecyl 2-bromobenzoate CAS Name: 2-bromobenzoic acid pentadecan-4-yl ester IUPAC Name: pentadecan-4-yl 2-bromobenzoate Traditional Name: 2-bromobenzoic acid 1-propyldodecyl ester Formula: C22H35BrO2 MolecularWeight: 411.4161

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35BrO2/c1-3-5-6-7-8-9-10-11-12-16-19(15-4-2)25-22(24)20-17-13-14-18-21(20)23/h13-14,17-19H,3-12,15-16H2,1-2H3