3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]thiazolidine-4-carboxylic acid CAS Name: 3-[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]thiazolidine-4-carboxylic acid Formula: C11H14N4O5S MolecularWeight: 314.31766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CSCC2C(=O)O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CSCC2C(=O)O)C)[N+](=O)[O-]

InChI

InChI=1S/C11H14N4O5S/c1-6-10(15(19)20)7(2)14(12-6)3-9(16)13-5-21-4-8(13)11(17)18/h8H,3-5H2,1-2H3,(H,17,18)