1-(dimethylamino)ethyl 3,4-bis(bromomethyl)benzoate

Systemtic Name: 1-(dimethylamino)ethyl 3,4-bis(bromomethyl)benzoate Openeye Name: 1-(dimethylamino)ethyl 3,4-bis(bromomethyl)benzoate CAS Name: 3,4-bis(bromomethyl)benzoic acid 1-(dimethylamino)ethyl ester IUPAC Name: 1-(dimethylamino)ethyl 3,4-bis(bromomethyl)benzoate Traditional Name: 3,4-bis(bromomethyl)benzoic acid 1-(dimethylamino)ethyl ester Formula: C13H17Br2NO2 MolecularWeight: 379.08758

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Descriptors Computed from Structure

Canonical SMILES:

CC(N(C)C)OC(=O)C1=CC(=C(C=C1)CBr)CBr

Isomeric SMILES

CC(N(C)C)OC(=O)C1=CC(=C(C=C1)CBr)CBr

InChI

InChI=1S/C13H17Br2NO2/c1-9(16(2)3)18-13(17)10-4-5-11(7-14)12(6-10)8-15/h4-6,9H,7-8H2,1-3H3