methyl 5-[(2,4-dimethylphenyl)methylamino]-2-fluoranyl-benzoate

Systemtic Name: methyl 5-[(2,4-dimethylphenyl)methylamino]-2-fluoranyl-benzoate Openeye Name: methyl 5-[(2,4-dimethylphenyl)methylamino]-2-fluoro-benzoate CAS Name: 5-[(2,4-dimethylphenyl)methylamino]-2-fluorobenzoic acid methyl ester IUPAC Name: methyl 5-[(2,4-dimethylphenyl)methylamino]-2-fluorobenzoate Traditional Name: 5-[(2,4-dimethylbenzyl)amino]-2-fluoro-benzoic acid methyl ester Formula: C17H18FNO2 MolecularWeight: 287.328723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CNC2=CC(=C(C=C2)F)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)CNC2=CC(=C(C=C2)F)C(=O)OC)C

InChI

InChI=1S/C17H18FNO2/c1-11-4-5-13(12(2)8-11)10-19-14-6-7-16(18)15(9-14)17(20)21-3/h4-9,19H,10H2,1-3H3