(2-bromanyl-6-dodecanoyl-4-methyl-phenyl) ethanoate

Systemtic Name: (2-bromanyl-6-dodecanoyl-4-methyl-phenyl) ethanoate Openeye Name: (2-bromo-6-dodecanoyl-4-methyl-phenyl) acetate CAS Name: acetic acid [2-bromo-4-methyl-6-(1-oxododecyl)phenyl] ester IUPAC Name: (2-bromo-6-dodecanoyl-4-methylphenyl) acetate Traditional Name: acetic acid (2-bromo-6-lauroyl-4-methyl-phenyl) ester Formula: C21H31BrO3 MolecularWeight: 411.37304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=CC(=CC(=C1OC(=O)C)Br)C

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CC(=CC(=C1OC(=O)C)Br)C

InChI

InChI=1S/C21H31BrO3/c1-4-5-6-7-8-9-10-11-12-13-20(24)18-14-16(2)15-19(22)21(18)25-17(3)23/h14-15H,4-13H2,1-3H3