2-(cyclopentylmethyl)-6-(3-fluoranyl-4-methoxy-phenyl)-3-oxidanylidene-pyridazine-4-carboxylic acid

Systemtic Name: 2-(cyclopentylmethyl)-6-(3-fluoranyl-4-methoxy-phenyl)-3-oxidanylidene-pyridazine-4-carboxylic acid Openeye Name: 2-(cyclopentylmethyl)-6-(3-fluoro-4-methoxy-phenyl)-3-oxo-pyridazine-4-carboxylic acid CAS Name: 2-(cyclopentylmethyl)-6-(3-fluoro-4-methoxyphenyl)-3-oxo-4-pyridazinecarboxylic acid IUPAC Name: 2-(cyclopentylmethyl)-6-(3-fluoro-4-methoxyphenyl)-3-oxopyridazine-4-carboxylic acid Traditional Name: 2-(cyclopentylmethyl)-6-(3-fluoro-4-methoxy-phenyl)-3-keto-pyridazine-4-carboxylic acid Formula: C18H19FN2O4 MolecularWeight: 346.352863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C(=C2)C(=O)O)CC3CCCC3)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C(=C2)C(=O)O)CC3CCCC3)F

InChI

InChI=1S/C18H19FN2O4/c1-25-16-7-6-12(8-14(16)19)15-9-13(18(23)24)17(22)21(20-15)10-11-4-2-3-5-11/h6-9,11H,2-5,10H2,1H3,(H,23,24)