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

Systemtic Name: 3-[[3-(1,5-dimethylpyrazol-4-yl)pyrazol-1-yl]methyl]benzoic acid Openeye Name: 3-[[3-(1,5-dimethylpyrazol-4-yl)pyrazol-1-yl]methyl]benzoic acid CAS Name: 3-[[3-(1,5-dimethyl-4-pyrazolyl)-1-pyrazolyl]methyl]benzoic acid IUPAC Name: 3-[[3-(1,5-dimethylpyrazol-4-yl)pyrazol-1-yl]methyl]benzoic acid Traditional Name: 3-[[3-(1,5-dimethylpyrazol-4-yl)pyrazol-1-yl]methyl]benzoic acid Formula: C16H16N4O2 MolecularWeight: 296.32384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C2=NN(C=C2)CC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1=C(C=NN1C)C2=NN(C=C2)CC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C16H16N4O2/c1-11-14(9-17-19(11)2)15-6-7-20(18-15)10-12-4-3-5-13(8-12)16(21)22/h3-9H,10H2,1-2H3,(H,21,22)