[1-oxidanylidene-1-(1-phenylethylamino)propan-2-yl] 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: [1-oxidanylidene-1-(1-phenylethylamino)propan-2-yl] 5-bromanyl-2-oxidanyl-benzoate Openeye Name: [1-methyl-2-oxo-2-(1-phenylethylamino)ethyl] 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid [1-oxo-1-(1-phenylethylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1-phenylethylamino)propan-2-yl] 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid [2-keto-1-methyl-2-(1-phenylethylamino)ethyl] ester Formula: C18H18BrNO4 MolecularWeight: 392.24382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=C(C=CC(=C2)Br)O

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C18H18BrNO4/c1-11(13-6-4-3-5-7-13)20-17(22)12(2)24-18(23)15-10-14(19)8-9-16(15)21/h3-12,21H,1-2H3,(H,20,22)