2-[1-(6-chloranylpyridazin-3-yl)-3,5-dimethyl-pyrazol-4-yl]-5-methoxy-benzoic acid

Systemtic Name: 2-[1-(6-chloranylpyridazin-3-yl)-3,5-dimethyl-pyrazol-4-yl]-5-methoxy-benzoic acid Openeye Name: 2-[1-(6-chloropyridazin-3-yl)-3,5-dimethyl-pyrazol-4-yl]-5-methoxy-benzoic acid CAS Name: 2-[1-(6-chloro-3-pyridazinyl)-3,5-dimethyl-4-pyrazolyl]-5-methoxybenzoic acid IUPAC Name: 2-[1-(6-chloropyridazin-3-yl)-3,5-dimethylpyrazol-4-yl]-5-methoxybenzoic acid Traditional Name: 2-[1-(6-chloropyridazin-3-yl)-3,5-dimethyl-pyrazol-4-yl]-5-methoxy-benzoic acid Formula: C17H15ClN4O3 MolecularWeight: 358.779

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NN=C(C=C2)Cl)C)C3=C(C=C(C=C3)OC)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=NN=C(C=C2)Cl)C)C3=C(C=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C17H15ClN4O3/c1-9-16(12-5-4-11(25-3)8-13(12)17(23)24)10(2)22(21-9)15-7-6-14(18)19-20-15/h4-8H,1-3H3,(H,23,24)