methyl 4-fluoranyl-3-(5-methylhexan-2-ylamino)benzoate

Systemtic Name: methyl 4-fluoranyl-3-(5-methylhexan-2-ylamino)benzoate Openeye Name: methyl 3-(1,4-dimethylpentylamino)-4-fluoro-benzoate CAS Name: 4-fluoro-3-(5-methylhexan-2-ylamino)benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-(5-methylhexan-2-ylamino)benzoate Traditional Name: 3-(1,4-dimethylpentylamino)-4-fluoro-benzoic acid methyl ester Formula: C15H22FNO2 MolecularWeight: 267.339083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22FNO2/c1-10(2)5-6-11(3)17-14-9-12(15(18)19-4)7-8-13(14)16/h7-11,17H,5-6H2,1-4H3