5-(2-chloranylphenoxy)carbonyl-2-(fluoranylmethyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 5-(2-chloranylphenoxy)carbonyl-2-(fluoranylmethyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-(2-chlorophenoxy)carbonyl-2-(fluoromethyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-[(2-chlorophenoxy)-oxomethyl]-2-(fluoromethyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-(2-chlorophenoxy)carbonyl-2-(fluoromethyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-(2-chlorophenoxy)carbonyl-2-(fluoromethyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C14H11ClFNO4 MolecularWeight: 311.692843

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=CNC(=C1C(=O)O)CF)C(=O)OC2=CC=CC=C2Cl

Isomeric SMILES

C1C(=CNC(=C1C(=O)O)CF)C(=O)OC2=CC=CC=C2Cl

InChI

InChI=1S/C14H11ClFNO4/c15-10-3-1-2-4-12(10)21-14(20)8-5-9(13(18)19)11(6-16)17-7-8/h1-4,7,17H,5-6H2,(H,18,19)