(2S,3S)-3-oxidanyl-2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]butanoic acid

Systemtic Name: (2S,3S)-3-oxidanyl-2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]butanoic acid Openeye Name: (2S,3S)-3-hydroxy-2-[[(E)-3-(2-thienyl)prop-2-enoyl]amino]butanoic acid CAS Name: (2S,3S)-3-hydroxy-2-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]butanoic acid IUPAC Name: (2S,3S)-3-hydroxy-2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]butanoic acid Traditional Name: (2S,3S)-3-hydroxy-2-[[(E)-3-(2-thienyl)acryloyl]amino]butyric acid Formula: C11H13NO4S MolecularWeight: 255.29022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)C=CC1=CC=CS1)O

Isomeric SMILES

C[C@@H]([C@@H](C(=O)O)NC(=O)/C=C/C1=CC=CS1)O

InChI

InChI=1S/C11H13NO4S/c1-7(13)10(11(15)16)12-9(14)5-4-8-3-2-6-17-8/h2-7,10,13H,1H3,(H,12,14)(H,15,16)/b5-4+/t7-,10-/m0/s1