3-(2-pyrazol-1-ylpropanoylamino)benzoic acid

Systemtic Name: 3-(2-pyrazol-1-ylpropanoylamino)benzoic acid Openeye Name: 3-(2-pyrazol-1-ylpropanoylamino)benzoic acid CAS Name: 3-[[1-oxo-2-(1-pyrazolyl)propyl]amino]benzoic acid IUPAC Name: 3-(2-pyrazol-1-ylpropanoylamino)benzoic acid Traditional Name: 3-(2-pyrazol-1-ylpropanoylamino)benzoic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)O)N2C=CC=N2

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)O)N2C=CC=N2

InChI

InChI=1S/C13H13N3O3/c1-9(16-7-3-6-14-16)12(17)15-11-5-2-4-10(8-11)13(18)19/h2-9H,1H3,(H,15,17)(H,18,19)