(2-oxidanylidene-2-thiophen-2-yl-ethyl) 3-[(4-bromophenyl)carbonylamino]propanoate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 3-[(4-bromophenyl)carbonylamino]propanoate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 3-[(4-bromobenzoyl)amino]propanoate CAS Name: 3-[[(4-bromophenyl)-oxomethyl]amino]propanoic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 3-[(4-bromobenzoyl)amino]propanoate Traditional Name: 3-[(4-bromobenzoyl)amino]propionic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C16H14BrNO4S MolecularWeight: 396.25566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrNO4S/c17-12-5-3-11(4-6-12)16(21)18-8-7-15(20)22-10-13(19)14-2-1-9-23-14/h1-6,9H,7-8,10H2,(H,18,21)