2,5-bis(fluoranyl)-4-heptan-3-yl-3-methoxy-benzoic acid

Systemtic Name: 2,5-bis(fluoranyl)-4-heptan-3-yl-3-methoxy-benzoic acid Openeye Name: 4-(1-ethylpentyl)-2,5-difluoro-3-methoxy-benzoic acid CAS Name: 2,5-difluoro-4-heptan-3-yl-3-methoxybenzoic acid IUPAC Name: 2,5-difluoro-4-heptan-3-yl-3-methoxybenzoic acid Traditional Name: 4-(1-ethylpentyl)-2,5-difluoro-3-methoxy-benzoic acid Formula: C15H20F2O3 MolecularWeight: 286.314306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1=C(C=C(C(=C1OC)F)C(=O)O)F

Isomeric SMILES

CCCCC(CC)C1=C(C=C(C(=C1OC)F)C(=O)O)F

InChI

InChI=1S/C15H20F2O3/c1-4-6-7-9(5-2)12-11(16)8-10(15(18)19)13(17)14(12)20-3/h8-9H,4-7H2,1-3H3,(H,18,19)