3,5-dimethyl-1-(2-oxidanylidene-2-phenylazanyl-ethyl)pyrazole-4-carboxylic acid

Systemtic Name: 3,5-dimethyl-1-(2-oxidanylidene-2-phenylazanyl-ethyl)pyrazole-4-carboxylic acid Openeye Name: 1-(2-anilino-2-oxo-ethyl)-3,5-dimethyl-pyrazole-4-carboxylic acid CAS Name: 1-(2-anilino-2-oxoethyl)-3,5-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(2-anilino-2-oxoethyl)-3,5-dimethylpyrazole-4-carboxylic acid Traditional Name: 1-(2-anilino-2-keto-ethyl)-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=CC=C2)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=CC=C2)C)C(=O)O

InChI

InChI=1S/C14H15N3O3/c1-9-13(14(19)20)10(2)17(16-9)8-12(18)15-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,15,18)(H,19,20)