[2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl] 3-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl] 3-bromanylbenzoate Openeye Name: [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-keto-2-[[(1R)-1-phenylethyl]amino]ethyl] ester Formula: C17H16BrNO3 MolecularWeight: 362.21784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)COC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)COC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C17H16BrNO3/c1-12(13-6-3-2-4-7-13)19-16(20)11-22-17(21)14-8-5-9-15(18)10-14/h2-10,12H,11H2,1H3,(H,19,20)/t12-/m1/s1