1-(3-fluoranyl-4-methoxy-phenyl)-4-(3-oxidanylpropyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(3-fluoranyl-4-methoxy-phenyl)-4-(3-oxidanylpropyl)pyrazole-3-carboxylic acid Openeye Name: 1-(3-fluoro-4-methoxy-phenyl)-4-(3-hydroxypropyl)pyrazole-3-carboxylic acid CAS Name: 1-(3-fluoro-4-methoxyphenyl)-4-(3-hydroxypropyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)-4-(3-hydroxypropyl)pyrazole-3-carboxylic acid Traditional Name: 1-(3-fluoro-4-methoxy-phenyl)-4-(3-hydroxypropyl)pyrazole-3-carboxylic acid Formula: C14H15FN2O4 MolecularWeight: 294.278303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=C(C(=N2)C(=O)O)CCCO)F

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=C(C(=N2)C(=O)O)CCCO)F

InChI

InChI=1S/C14H15FN2O4/c1-21-12-5-4-10(7-11(12)15)17-8-9(3-2-6-18)13(16-17)14(19)20/h4-5,7-8,18H,2-3,6H2,1H3,(H,19,20)