methyl 2-[(2-aminophenyl)methylamino]-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate

Systemtic Name: methyl 2-[(2-aminophenyl)methylamino]-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate Openeye Name: methyl 2-[(2-aminophenyl)methylamino]-3,3,3-trifluoro-2-hydroxy-propanoate CAS Name: 2-[(2-aminophenyl)methylamino]-3,3,3-trifluoro-2-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[(2-aminophenyl)methylamino]-3,3,3-trifluoro-2-hydroxypropanoate Traditional Name: 2-[(2-aminobenzyl)amino]-3,3,3-trifluoro-2-hydroxy-propionic acid methyl ester Formula: C11H13F3N2O3 MolecularWeight: 278.22773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(F)(F)F)(NCC1=CC=CC=C1N)O

Isomeric SMILES

COC(=O)C(C(F)(F)F)(NCC1=CC=CC=C1N)O

InChI

InChI=1S/C11H13F3N2O3/c1-19-9(17)10(18,11(12,13)14)16-6-7-4-2-3-5-8(7)15/h2-5,16,18H,6,15H2,1H3