dodecan-2-yl 3-bromanylbenzoate

Systemtic Name: dodecan-2-yl 3-bromanylbenzoate Openeye Name: 1-methylundecyl 3-bromobenzoate CAS Name: 3-bromobenzoic acid dodecan-2-yl ester IUPAC Name: dodecan-2-yl 3-bromobenzoate Traditional Name: 3-bromobenzoic acid 1-methylundecyl ester Formula: C19H29BrO2 MolecularWeight: 369.33636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C)OC(=O)C1=CC(=CC=C1)Br

Isomeric SMILES

CCCCCCCCCCC(C)OC(=O)C1=CC(=CC=C1)Br

InChI

InChI=1S/C19H29BrO2/c1-3-4-5-6-7-8-9-10-12-16(2)22-19(21)17-13-11-14-18(20)15-17/h11,13-16H,3-10,12H2,1-2H3