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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCN2C=CC=N2

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCN2C=CC=N2

InChI

InChI=1S/C13H13N3O3/c17-12(6-9-16-8-3-7-14-16)15-11-5-2-1-4-10(11)13(18)19/h1-5,7-8H,6,9H2,(H,15,17)(H,18,19)