3-[1-(3-cyanophenyl)-3,5-dimethyl-pyrazol-4-yl]propanoic acid

Systemtic Name: 3-[1-(3-cyanophenyl)-3,5-dimethyl-pyrazol-4-yl]propanoic acid Openeye Name: 3-[1-(3-cyanophenyl)-3,5-dimethyl-pyrazol-4-yl]propanoic acid CAS Name: 3-[1-(3-cyanophenyl)-3,5-dimethyl-4-pyrazolyl]propanoic acid IUPAC Name: 3-[1-(3-cyanophenyl)-3,5-dimethylpyrazol-4-yl]propanoic acid Traditional Name: 3-[1-(3-cyanophenyl)-3,5-dimethyl-pyrazol-4-yl]propionic acid Formula: C15H15N3O2 MolecularWeight: 269.2985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC(=C2)C#N)C)CCC(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC(=C2)C#N)C)CCC(=O)O

InChI

InChI=1S/C15H15N3O2/c1-10-14(6-7-15(19)20)11(2)18(17-10)13-5-3-4-12(8-13)9-16/h3-5,8H,6-7H2,1-2H3,(H,19,20)