(2S,4S)-4-azanyl-5-oxidanylidene-4-(pyridin-1-ium-1-ylmethyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-4-azanyl-5-oxidanylidene-4-(pyridin-1-ium-1-ylmethyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-4-amino-5-oxo-4-(pyridin-1-ium-1-ylmethyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-4-amino-5-oxo-4-(1-pyridin-1-iumylmethyl)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-4-amino-5-oxo-4-(pyridin-1-ium-1-ylmethyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-4-amino-5-keto-4-(pyridin-1-ium-1-ylmethyl)proline Formula: C11H14N3O3+ MolecularWeight: 236.24716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C1(C[N+]2=CC=CC=C2)N)C(=O)O

Isomeric SMILES

C1[C@H](NC(=O)[C@]1(C[N+]2=CC=CC=C2)N)C(=O)O

InChI

InChI=1S/C11H13N3O3/c12-11(7-14-4-2-1-3-5-14)6-8(9(15)16)13-10(11)17/h1-5,8H,6-7,12H2,(H-,13,15,16,17)/p+1/t8-,11-/m0/s1