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

Systemtic Name: (2R,4S)-4-methoxy-1-[(E)-3-thiophen-2-ylprop-2-enoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2R,4S)-4-methoxy-1-[(E)-3-(2-thienyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: (2R,4S)-4-methoxy-1-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4S)-4-methoxy-1-[(E)-3-thiophen-2-ylprop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2R,4S)-4-methoxy-1-[(E)-3-(2-thienyl)acryloyl]proline Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)C=CC2=CC=CS2)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO4S/c1-18-9-7-11(13(16)17)14(8-9)12(15)5-4-10-3-2-6-19-10/h2-6,9,11H,7-8H2,1H3,(H,16,17)/b5-4+/t9-,11+/m0/s1