4-[3-(4-chlorophenyl)pyrazol-1-yl]butanoic acid

Systemtic Name: 4-[3-(4-chlorophenyl)pyrazol-1-yl]butanoic acid Openeye Name: 4-[3-(4-chlorophenyl)pyrazol-1-yl]butanoic acid CAS Name: 4-[3-(4-chlorophenyl)-1-pyrazolyl]butanoic acid IUPAC Name: 4-[3-(4-chlorophenyl)pyrazol-1-yl]butanoic acid Traditional Name: 4-[3-(4-chlorophenyl)pyrazol-1-yl]butyric acid Formula: C13H13ClN2O2 MolecularWeight: 264.70752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C=C2)CCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C=C2)CCCC(=O)O)Cl

InChI

InChI=1S/C13H13ClN2O2/c14-11-5-3-10(4-6-11)12-7-9-16(15-12)8-1-2-13(17)18/h3-7,9H,1-2,8H2,(H,17,18)