methyl 4-fluoranyl-3-(4-methylpentan-2-ylamino)benzoate

Systemtic Name: methyl 4-fluoranyl-3-(4-methylpentan-2-ylamino)benzoate Openeye Name: methyl 3-(1,3-dimethylbutylamino)-4-fluoro-benzoate CAS Name: 4-fluoro-3-(4-methylpentan-2-ylamino)benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-(4-methylpentan-2-ylamino)benzoate Traditional Name: 3-(1,3-dimethylbutylamino)-4-fluoro-benzoic acid methyl ester Formula: C14H20FNO2 MolecularWeight: 253.312503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20FNO2/c1-9(2)7-10(3)16-13-8-11(14(17)18-4)5-6-12(13)15/h5-6,8-10,16H,7H2,1-4H3