(2R,4S)-4-oxidanyl-1-[(E)-3-thiophen-2-ylprop-2-enoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,4S)-4-oxidanyl-1-[(E)-3-thiophen-2-ylprop-2-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2R,4S)-4-hydroxy-1-[(E)-3-(2-thienyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: (2R,4S)-4-hydroxy-1-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4S)-4-hydroxy-1-[(E)-3-thiophen-2-ylprop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2R,4S)-4-hydroxy-1-[(E)-3-(2-thienyl)acryloyl]proline Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C(=O)C=CC2=CC=CS2)O

Isomeric SMILES

C1[C@@H](CN([C@H]1C(=O)O)C(=O)/C=C/C2=CC=CS2)O

InChI

InChI=1S/C12H13NO4S/c14-8-6-10(12(16)17)13(7-8)11(15)4-3-9-2-1-5-18-9/h1-5,8,10,14H,6-7H2,(H,16,17)/b4-3+/t8-,10+/m0/s1