(2R,3R)-2,3-diphenylbutanedioic acid; (2S)-pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,3R)-2,3-diphenylbutanedioic acid; (2S)-pyrrolidine-2-carboxylic acid Openeye Name: (2R,3R)-2,3-diphenylbutanedioic acid; (2S)-pyrrolidine-2-carboxylic acid CAS Name: (2R,3R)-2,3-diphenylbutanedioic acid; (2S)-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,3R)-2,3-diphenylbutanedioic acid; (2S)-pyrrolidine-2-carboxylic acid Traditional Name: (2R,3R)-2,3-diphenylsuccinic acid; (2S)-proline Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)O.C1=CC=C(C=C1)C(C(C2=CC=CC=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1C[C@H](NC1)C(=O)O.C1=CC=C(C=C1)[C@@H]([C@H](C2=CC=CC=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C16H14O4.C5H9NO2/c17-15(18)13(11-7-3-1-4-8-11)14(16(19)20)12-9-5-2-6-10-12;7-5(8)4-2-1-3-6-4/h1-10,13-14H,(H,17,18)(H,19,20);4,6H,1-3H2,(H,7,8)/t13-,14-;4-/m00/s1