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

Systemtic Name: methyl 4-fluoranyl-3-(3-methylbutan-2-ylamino)benzoate Openeye Name: methyl 3-(1,2-dimethylpropylamino)-4-fluoro-benzoate CAS Name: 4-fluoro-3-(3-methylbutan-2-ylamino)benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-(3-methylbutan-2-ylamino)benzoate Traditional Name: 3-(1,2-dimethylpropylamino)-4-fluoro-benzoic acid methyl ester Formula: C13H18FNO2 MolecularWeight: 239.285923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18FNO2/c1-8(2)9(3)15-12-7-10(13(16)17-4)5-6-11(12)14/h5-9,15H,1-4H3