[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] 5-bromanyl-2-chloranyl-benzoate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C18H15BrClNO4 MolecularWeight: 424.673

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=C(C=CC(=C2)Br)Cl

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=C(C=CC(=C2)Br)Cl

InChI

InChI=1S/C18H15BrClNO4/c1-2-17(23)21-13-6-3-11(4-7-13)16(22)10-25-18(24)14-9-12(19)5-8-15(14)20/h3-9H,2,10H2,1H3,(H,21,23)