methyl 2-[[2,4-bis(oxidanyl)phenyl]methylamino]-4-fluoranyl-benzoate

Systemtic Name: methyl 2-[[2,4-bis(oxidanyl)phenyl]methylamino]-4-fluoranyl-benzoate Openeye Name: methyl 2-[(2,4-dihydroxyphenyl)methylamino]-4-fluoro-benzoate CAS Name: 2-[(2,4-dihydroxyphenyl)methylamino]-4-fluorobenzoic acid methyl ester IUPAC Name: methyl 2-[(2,4-dihydroxyphenyl)methylamino]-4-fluorobenzoate Traditional Name: 2-[(2,4-dihydroxybenzyl)amino]-4-fluoro-benzoic acid methyl ester Formula: C15H14FNO4 MolecularWeight: 291.274363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)F)NCC2=C(C=C(C=C2)O)O

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)F)NCC2=C(C=C(C=C2)O)O

InChI

InChI=1S/C15H14FNO4/c1-21-15(20)12-5-3-10(16)6-13(12)17-8-9-2-4-11(18)7-14(9)19/h2-7,17-19H,8H2,1H3