[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] (2S)-2-benzamidopropanoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] (2S)-2-benzamidopropanoate CAS Name: (2S)-2-benzamidopropanoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] (2S)-2-benzamidopropanoate Traditional Name: (2S)-2-benzamidopropionic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C16H14BrNO4S MolecularWeight: 396.25566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)C1=CC=C(S1)Br)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)C1=CC=C(S1)Br)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H14BrNO4S/c1-10(18-15(20)11-5-3-2-4-6-11)16(21)22-9-12(19)13-7-8-14(17)23-13/h2-8,10H,9H2,1H3,(H,18,20)/t10-/m0/s1