(2S)-1-(2-methyl-6-nitro-phenyl)carbonylpyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-(2-methyl-6-nitro-phenyl)carbonylpyrrolidine-2-carboxylate Openeye Name: (2S)-1-(2-methyl-6-nitro-benzoyl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2-methyl-6-nitrophenyl)-oxomethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-(2-methyl-6-nitrobenzoyl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-methyl-6-nitro-benzoyl)pyrrolidine-2-carboxylate Formula: C13H13N2O5- MolecularWeight: 277.25272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)N2CCCC2C(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)N2CCC[C@H]2C(=O)[O-]

InChI

InChI=1S/C13H14N2O5/c1-8-4-2-5-9(15(19)20)11(8)12(16)14-7-3-6-10(14)13(17)18/h2,4-5,10H,3,6-7H2,1H3,(H,17,18)/p-1/t10-/m0/s1