(3R,5S)-5-methyl-1-(4-nitrophenyl)carbonyl-pyrrolidine-3-carboxylic acid

Systemtic Name: (3R,5S)-5-methyl-1-(4-nitrophenyl)carbonyl-pyrrolidine-3-carboxylic acid Openeye Name: (3R,5S)-5-methyl-1-(4-nitrobenzoyl)pyrrolidine-3-carboxylic acid CAS Name: (3R,5S)-5-methyl-1-[(4-nitrophenyl)-oxomethyl]-3-pyrrolidinecarboxylic acid IUPAC Name: (3R,5S)-5-methyl-1-(4-nitrobenzoyl)pyrrolidine-3-carboxylic acid Traditional Name: (3R,5S)-5-methyl-1-(4-nitrobenzoyl)pyrrolidine-3-carboxylic acid Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C[C@H]1C[C@H](CN1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H14N2O5/c1-8-6-10(13(17)18)7-14(8)12(16)9-2-4-11(5-3-9)15(19)20/h2-5,8,10H,6-7H2,1H3,(H,17,18)/t8-,10+/m0/s1