[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-(3-bromanylphenoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-(3-bromanylphenoxy)ethanoate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 2-(3-bromophenoxy)acetate CAS Name: 2-(3-bromophenoxy)acetic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 2-(3-bromophenoxy)acetate Traditional Name: 2-(3-bromophenoxy)acetic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C16H16BrNO4S MolecularWeight: 398.27154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCC(=O)OCC(=O)NCCC2=CC=CS2

Isomeric SMILES

C1=CC(=CC(=C1)Br)OCC(=O)OCC(=O)NCCC2=CC=CS2

InChI

InChI=1S/C16H16BrNO4S/c17-12-3-1-4-13(9-12)21-11-16(20)22-10-15(19)18-7-6-14-5-2-8-23-14/h1-5,8-9H,6-7,10-11H2,(H,18,19)