methyl 2-fluoranyl-5-(3-methylpentan-2-ylamino)benzoate

Systemtic Name: methyl 2-fluoranyl-5-(3-methylpentan-2-ylamino)benzoate Openeye Name: methyl 5-(1,2-dimethylbutylamino)-2-fluoro-benzoate CAS Name: 2-fluoro-5-(3-methylpentan-2-ylamino)benzoic acid methyl ester IUPAC Name: methyl 2-fluoro-5-(3-methylpentan-2-ylamino)benzoate Traditional Name: 5-(1,2-dimethylbutylamino)-2-fluoro-benzoic acid methyl ester Formula: C14H20FNO2 MolecularWeight: 253.312503

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)NC1=CC(=C(C=C1)F)C(=O)OC

Isomeric SMILES

CCC(C)C(C)NC1=CC(=C(C=C1)F)C(=O)OC

InChI

InChI=1S/C14H20FNO2/c1-5-9(2)10(3)16-11-6-7-13(15)12(8-11)14(17)18-4/h6-10,16H,5H2,1-4H3