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

Systemtic Name: 4-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]benzoic acid Openeye Name: 4-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]benzoic acid CAS Name: 4-[[3-(3,5-dimethyl-1-pyrazolyl)-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]benzoic acid Traditional Name: 4-[3-(3,5-dimethylpyrazol-1-yl)propanoylamino]benzoic acid Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC2=CC=C(C=C2)C(=O)O)C

InChI

InChI=1S/C15H17N3O3/c1-10-9-11(2)18(17-10)8-7-14(19)16-13-5-3-12(4-6-13)15(20)21/h3-6,9H,7-8H2,1-2H3,(H,16,19)(H,20,21)