2,2,2-tris(bromanyl)ethyl 4-methylbenzoate

Systemtic Name: 2,2,2-tris(bromanyl)ethyl 4-methylbenzoate Openeye Name: 2,2,2-tribromoethyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid 2,2,2-tribromoethyl ester IUPAC Name: 2,2,2-tribromoethyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid 2,2,2-tribromoethyl ester Formula: C10H9Br3O2 MolecularWeight: 400.88926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC(Br)(Br)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC(Br)(Br)Br

InChI

InChI=1S/C10H9Br3O2/c1-7-2-4-8(5-3-7)9(14)15-6-10(11,12)13/h2-5H,6H2,1H3