1-(2-oxidanylidene-4-pyrrolidin-1-yl-chromen-3-yl)-3-[2-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(2-oxidanylidene-4-pyrrolidin-1-yl-chromen-3-yl)-3-[2-(trifluoromethyl)phenyl]urea Openeye Name: 1-(2-oxo-4-pyrrolidin-1-yl-chromen-3-yl)-3-[2-(trifluoromethyl)phenyl]urea CAS Name: 1-[2-oxo-4-(1-pyrrolidinyl)-1-benzopyran-3-yl]-3-[2-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(2-oxo-4-pyrrolidin-1-ylchromen-3-yl)-3-[2-(trifluoromethyl)phenyl]urea Traditional Name: 1-(2-keto-4-pyrrolidino-chromen-3-yl)-3-[2-(trifluoromethyl)phenyl]urea Formula: C21H18F3N3O3 MolecularWeight: 417.38113

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=O)OC3=CC=CC=C32)NC(=O)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CCN(C1)C2=C(C(=O)OC3=CC=CC=C32)NC(=O)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H18F3N3O3/c22-21(23,24)14-8-2-3-9-15(14)25-20(29)26-17-18(27-11-5-6-12-27)13-7-1-4-10-16(13)30-19(17)28/h1-4,7-10H,5-6,11-12H2,(H2,25,26,29)