(2S,3S,4S)-3-(carboxymethyl)-4-quinoxalin-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,3S,4S)-3-(carboxymethyl)-4-quinoxalin-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: (2S,3S,4S)-3-(carboxymethyl)-4-quinoxalin-2-yl-pyrrolidine-2-carboxylic acid CAS Name: (2S,3S,4S)-3-(carboxymethyl)-4-(2-quinoxalinyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,3S,4S)-3-(carboxymethyl)-4-quinoxalin-2-ylpyrrolidine-2-carboxylic acid Traditional Name: (2S,3S,4S)-3-(carboxymethyl)-4-quinoxalin-2-yl-proline Formula: C15H15N3O4 MolecularWeight: 301.2973

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(N1)C(=O)O)CC(=O)O)C2=NC3=CC=CC=C3N=C2

Isomeric SMILES

C1[C@H]([C@@H]([C@H](N1)C(=O)O)CC(=O)O)C2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C15H15N3O4/c19-13(20)5-8-9(6-17-14(8)15(21)22)12-7-16-10-3-1-2-4-11(10)18-12/h1-4,7-9,14,17H,5-6H2,(H,19,20)(H,21,22)/t8-,9+,14-/m0/s1