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

Systemtic Name: 1-[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-hydroxy-1-[(E)-3-(3-methyl-2-thienyl)prop-2-enoyl]pyrrolidine-2-carboxylic acid CAS Name: 4-hydroxy-1-[(E)-3-(3-methyl-2-thiophenyl)-1-oxoprop-2-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-hydroxy-1-[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-hydroxy-1-[(E)-3-(3-methyl-2-thienyl)acryloyl]proline Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=CC(=O)N2CC(CC2C(=O)O)O

Isomeric SMILES

CC1=C(SC=C1)/C=C/C(=O)N2CC(CC2C(=O)O)O

InChI

InChI=1S/C13H15NO4S/c1-8-4-5-19-11(8)2-3-12(16)14-7-9(15)6-10(14)13(17)18/h2-5,9-10,15H,6-7H2,1H3,(H,17,18)/b3-2+