(2S)-1-[(2-nitrophenyl)methyl]-5-oxidanylidene-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2-nitrophenyl)methyl]-5-oxidanylidene-pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2-nitrophenyl)methyl]-5-oxo-pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2-nitrophenyl)methyl]-5-oxo-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2-nitrophenyl)methyl]-5-oxopyrrolidine-2-carboxylic acid Traditional Name: (2S)-5-keto-1-(2-nitrobenzyl)proline Formula: C12H12N2O5 MolecularWeight: 264.23408

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1C(=O)O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N([C@@H]1C(=O)O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O5/c15-11-6-5-10(12(16)17)13(11)7-8-3-1-2-4-9(8)14(18)19/h1-4,10H,5-7H2,(H,16,17)/t10-/m0/s1