1-[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-hydroxy-1-[(E)-3-(2-methylthiazol-4-yl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: 4-hydroxy-1-[(E)-3-(2-methyl-4-thiazolyl)-1-oxoprop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-hydroxy-1-[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-hydroxy-1-[(E)-3-(2-methylthiazol-4-yl)acryloyl]proline Formula: C12H14N2O4S MolecularWeight: 282.31556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C=CC(=O)N2CC(CC2C(=O)O)O

Isomeric SMILES

CC1=NC(=CS1)/C=C/C(=O)N2CC(CC2C(=O)O)O

InChI

InChI=1S/C12H14N2O4S/c1-7-13-8(6-19-7)2-3-11(16)14-5-9(15)4-10(14)12(17)18/h2-3,6,9-10,15H,4-5H2,1H3,(H,17,18)/b3-2+