methyl (2S,4S)-1-ethanoyl-4-[(4-nitrophenyl)carbonylamino]pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4S)-1-ethanoyl-4-[(4-nitrophenyl)carbonylamino]pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4S)-1-acetyl-4-[(4-nitrobenzoyl)amino]pyrrolidine-2-carboxylate CAS Name: (2S,4S)-1-acetyl-4-[[(4-nitrophenyl)-oxomethyl]amino]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S)-1-acetyl-4-[(4-nitrobenzoyl)amino]pyrrolidine-2-carboxylate Traditional Name: (2S,4S)-1-acetyl-4-[(4-nitrobenzoyl)amino]pyrrolidine-2-carboxylic acid methyl ester Formula: C15H17N3O6 MolecularWeight: 335.31198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)OC)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1C[C@H](C[C@H]1C(=O)OC)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O6/c1-9(19)17-8-11(7-13(17)15(21)24-2)16-14(20)10-3-5-12(6-4-10)18(22)23/h3-6,11,13H,7-8H2,1-2H3,(H,16,20)/t11-,13-/m0/s1