(2S)-2-(naphthalen-1-ylsulfonylamino)propanoic acid; (2S)-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-2-(naphthalen-1-ylsulfonylamino)propanoic acid; (2S)-pyrrolidine-2-carboxylic acid Openeye Name: (2S)-2-(1-naphthylsulfonylamino)propanoic acid; (2S)-pyrrolidine-2-carboxylic acid CAS Name: (2S)-2-(1-naphthalenylsulfonylamino)propanoic acid; (2S)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-2-(naphthalen-1-ylsulfonylamino)propanoic acid; (2S)-pyrrolidine-2-carboxylic acid Traditional Name: (2S)-2-(1-naphthylsulfonylamino)propionic acid; (2S)-proline Formula: C18H22N2O6S MolecularWeight: 394.44208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NS(=O)(=O)C1=CC=CC2=CC=CC=C21.C1CC(NC1)C(=O)O

Isomeric SMILES

C[C@@H](C(=O)O)NS(=O)(=O)C1=CC=CC2=CC=CC=C21.C1C[C@H](NC1)C(=O)O

InChI

InChI=1S/C13H13NO4S.C5H9NO2/c1-9(13(15)16)14-19(17,18)12-8-4-6-10-5-2-3-7-11(10)12;7-5(8)4-2-1-3-6-4/h2-9,14H,1H3,(H,15,16);4,6H,1-3H2,(H,7,8)/t9-;4-/m00/s1