(2S)-1-[(5-methyl-4-nitro-1H-pyrazol-3-yl)carbonyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(5-methyl-4-nitro-1H-pyrazol-3-yl)carbonyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-(5-methyl-4-nitro-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(5-methyl-4-nitro-1H-pyrazol-3-yl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(5-methyl-4-nitro-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-(5-methyl-4-nitro-1H-pyrazole-3-carbonyl)proline Formula: C10H12N4O5 MolecularWeight: 268.22608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C(=O)N2CCCC2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1)C(=O)N2CCC[C@H]2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H12N4O5/c1-5-8(14(18)19)7(12-11-5)9(15)13-4-2-3-6(13)10(16)17/h6H,2-4H2,1H3,(H,11,12)(H,16,17)/t6-/m0/s1