[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 3-bromanyl-5-ethoxy-4-methoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 3-bromanyl-5-ethoxy-4-methoxy-benzoate Openeye Name: [2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl] 3-bromo-5-ethoxy-4-methoxy-benzoate CAS Name: 3-bromo-5-ethoxy-4-methoxybenzoic acid [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] 3-bromo-5-ethoxy-4-methoxybenzoate Traditional Name: 3-bromo-5-ethoxy-4-methoxy-benzoic acid [2-keto-2-[[(1S)-1-methylbutyl]amino]ethyl] ester Formula: C17H24BrNO5 MolecularWeight: 402.28016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CC(=C(C(=C1)Br)OC)OCC

Isomeric SMILES

CCC[C@H](C)NC(=O)COC(=O)C1=CC(=C(C(=C1)Br)OC)OCC

InChI

InChI=1S/C17H24BrNO5/c1-5-7-11(3)19-15(20)10-24-17(21)12-8-13(18)16(22-4)14(9-12)23-6-2/h8-9,11H,5-7,10H2,1-4H3,(H,19,20)/t11-/m0/s1