5-bromanyl-3-[[1-diethoxyphosphoryl-2,2,2-tris(fluoranyl)ethyl]amino]indol-2-one

Systemtic Name: 5-bromanyl-3-[[1-diethoxyphosphoryl-2,2,2-tris(fluoranyl)ethyl]amino]indol-2-one Openeye Name: 5-bromo-3-[(1-diethoxyphosphoryl-2,2,2-trifluoro-ethyl)amino]indol-2-one CAS Name: 5-bromo-3-[(1-diethoxyphosphoryl-2,2,2-trifluoroethyl)amino]-2-indolone IUPAC Name: 5-bromo-3-[(1-diethoxyphosphoryl-2,2,2-trifluoroethyl)amino]indol-2-one Traditional Name: 5-bromo-3-[(1-diethoxyphosphoryl-2,2,2-trifluoro-ethyl)amino]indol-2-one Formula: C14H15BrF3N2O4P MolecularWeight: 443.152871

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C(F)(F)F)NC1=C2C=C(C=CC2=NC1=O)Br)OCC

Isomeric SMILES

CCOP(=O)(C(C(F)(F)F)NC1=C2C=C(C=CC2=NC1=O)Br)OCC

InChI

InChI=1S/C14H15BrF3N2O4P/c1-3-23-25(22,24-4-2)13(14(16,17)18)20-11-9-7-8(15)5-6-10(9)19-12(11)21/h5-7,13H,3-4H2,1-2H3,(H,19,20,21)