2-[[1-ethoxy-3-(1-ethoxy-1-oxidanylidene-octan-2-yl)sulfanyl-1-oxidanylidene-propan-2-yl]amino]propanoic acid; pyrrolidine-2-carboxylic acid

Systemtic Name: 2-[[1-ethoxy-3-(1-ethoxy-1-oxidanylidene-octan-2-yl)sulfanyl-1-oxidanylidene-propan-2-yl]amino]propanoic acid; pyrrolidine-2-carboxylic acid Openeye Name: 2-[[2-ethoxy-1-(1-ethoxycarbonylheptylsulfanylmethyl)-2-oxo-ethyl]amino]propanoic acid; pyrrolidine-2-carboxylic acid CAS Name: 2-[[1-ethoxy-3-[(1-ethoxy-1-oxooctan-2-yl)thio]-1-oxopropan-2-yl]amino]propanoic acid; 2-pyrrolidinecarboxylic acid IUPAC Name: 2-[[1-ethoxy-3-(1-ethoxy-1-oxooctan-2-yl)sulfanyl-1-oxopropan-2-yl]amino]propanoic acid; pyrrolidine-2-carboxylic acid Traditional Name: 2-[[1-[(1-carbethoxyheptylthio)methyl]-2-ethoxy-2-keto-ethyl]amino]propionic acid; proline Formula: C23H42N2O8S MolecularWeight: 506.65318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OCC)SCC(C(=O)OCC)NC(C)C(=O)O.C1CC(NC1)C(=O)O

Isomeric SMILES

CCCCCCC(C(=O)OCC)SCC(C(=O)OCC)NC(C)C(=O)O.C1CC(NC1)C(=O)O

InChI

InChI=1S/C18H33NO6S.C5H9NO2/c1-5-8-9-10-11-15(18(23)25-7-3)26-12-14(17(22)24-6-2)19-13(4)16(20)21;7-5(8)4-2-1-3-6-4/h13-15,19H,5-12H2,1-4H3,(H,20,21);4,6H,1-3H2,(H,7,8)