4-[2-(3,5-dimethylpyrazol-1-yl)ethanoylamino]benzoic acid

Systemtic Name: 4-[2-(3,5-dimethylpyrazol-1-yl)ethanoylamino]benzoic acid Openeye Name: 4-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]benzoic acid CAS Name: 4-[[2-(3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]benzoic acid Traditional Name: 4-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]benzoic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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