[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 4-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 4-bromanylbenzoate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C15H14BrNO3S MolecularWeight: 368.24556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC(=O)COC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1=CSC(=C1)CCNC(=O)COC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C15H14BrNO3S/c16-12-5-3-11(4-6-12)15(19)20-10-14(18)17-8-7-13-2-1-9-21-13/h1-6,9H,7-8,10H2,(H,17,18)