4-(3-pyrazol-1-ylpropanoylamino)benzoic acid

Systemtic Name: 4-(3-pyrazol-1-ylpropanoylamino)benzoic acid Openeye Name: 4-(3-pyrazol-1-ylpropanoylamino)benzoic acid CAS Name: 4-[[1-oxo-3-(1-pyrazolyl)propyl]amino]benzoic acid IUPAC Name: 4-(3-pyrazol-1-ylpropanoylamino)benzoic acid Traditional Name: 4-(3-pyrazol-1-ylpropanoylamino)benzoic acid Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CCC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CN(N=C1)CCC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

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