N-[2-[[2,6-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]-N-ethyl-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-[2-[[2,6-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]-N-ethyl-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-[2-(2,6-difluoroanilino)-2-oxo-ethyl]-N-ethyl-2-morpholino-5-nitro-benzamide CAS Name: N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-[2-(2,6-difluoroanilino)-2-keto-ethyl]-N-ethyl-2-morpholino-5-nitro-benzamide Formula: C21H22F2N4O5 MolecularWeight: 448.419986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=C(C=CC=C1F)F)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CCN(CC(=O)NC1=C(C=CC=C1F)F)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C21H22F2N4O5/c1-2-25(13-19(28)24-20-16(22)4-3-5-17(20)23)21(29)15-12-14(27(30)31)6-7-18(15)26-8-10-32-11-9-26/h3-7,12H,2,8-11,13H2,1H3,(H,24,28)