methyl 3,5-bis(6-bromanylhexanoylamino)benzoate

Systemtic Name: methyl 3,5-bis(6-bromanylhexanoylamino)benzoate Openeye Name: methyl 3,5-bis(6-bromohexanoylamino)benzoate CAS Name: 3,5-bis[(6-bromo-1-oxohexyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3,5-bis(6-bromohexanoylamino)benzoate Traditional Name: 3,5-bis(6-bromohexanoylamino)benzoic acid methyl ester Formula: C20H28Br2N2O4 MolecularWeight: 520.25532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCCCBr)NC(=O)CCCCCBr

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCCCBr)NC(=O)CCCCCBr

InChI

InChI=1S/C20H28Br2N2O4/c1-28-20(27)15-12-16(23-18(25)8-4-2-6-10-21)14-17(13-15)24-19(26)9-5-3-7-11-22/h12-14H,2-11H2,1H3,(H,23,25)(H,24,26)