methyl 3-[(3-cyanophenyl)methylamino]-4-fluoranyl-benzoate

Systemtic Name: methyl 3-[(3-cyanophenyl)methylamino]-4-fluoranyl-benzoate Openeye Name: methyl 3-[(3-cyanophenyl)methylamino]-4-fluoro-benzoate CAS Name: 3-[(3-cyanophenyl)methylamino]-4-fluorobenzoic acid methyl ester IUPAC Name: methyl 3-[(3-cyanophenyl)methylamino]-4-fluorobenzoate Traditional Name: 3-[(3-cyanobenzyl)amino]-4-fluoro-benzoic acid methyl ester Formula: C16H13FN2O2 MolecularWeight: 284.285023

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)F)NCC2=CC=CC(=C2)C#N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)F)NCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H13FN2O2/c1-21-16(20)13-5-6-14(17)15(8-13)19-10-12-4-2-3-11(7-12)9-18/h2-8,19H,10H2,1H3