4-ethoxycarbonyl-1-(propan-2-ylcarbamoyl)-5-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-ethoxycarbonyl-1-(propan-2-ylcarbamoyl)-5-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 4-ethoxycarbonyl-1-(isopropylcarbamoyl)-5-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 4-ethoxycarbonyl-1-[oxo-(propan-2-ylamino)methyl]-5-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-ethoxycarbonyl-1-(propan-2-ylcarbamoyl)-5-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 4-carbethoxy-1-(isopropylcarbamoyl)-5-(2-thienyl)proline Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(N(C1C2=CC=CS2)C(=O)NC(C)C)C(=O)O

Isomeric SMILES

CCOC(=O)C1CC(N(C1C2=CC=CS2)C(=O)NC(C)C)C(=O)O

InChI

InChI=1S/C16H22N2O5S/c1-4-23-15(21)10-8-11(14(19)20)18(16(22)17-9(2)3)13(10)12-6-5-7-24-12/h5-7,9-11,13H,4,8H2,1-3H3,(H,17,22)(H,19,20)