2-[7-fluoranyl-4-(3-iodanylprop-2-ynyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]isoindole-1,3-dione

Systemtic Name: 2-[7-fluoranyl-4-(3-iodanylprop-2-ynyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]isoindole-1,3-dione Openeye Name: 2-[7-fluoro-4-(3-iodoprop-2-ynyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]isoindoline-1,3-dione CAS Name: 2-[7-fluoro-4-(3-iodoprop-2-ynyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]isoindole-1,3-dione IUPAC Name: 2-[7-fluoro-4-(3-iodoprop-2-ynyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]isoindole-1,3-dione Traditional Name: 2-[7-fluoro-4-(3-iodoprop-2-ynyl)-3-keto-2-methyl-1,4-benzoxazin-6-yl]isoindoline-1,3-quinone Formula: C20H12FIN2O4 MolecularWeight: 490.223153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC(=C(C=C2O1)F)N3C(=O)C4=CC=CC=C4C3=O)CC#CI

Isomeric SMILES

CC1C(=O)N(C2=CC(=C(C=C2O1)F)N3C(=O)C4=CC=CC=C4C3=O)CC#CI

InChI

InChI=1S/C20H12FIN2O4/c1-11-18(25)23(8-4-7-22)16-10-15(14(21)9-17(16)28-11)24-19(26)12-5-2-3-6-13(12)20(24)27/h2-3,5-6,9-11H,8H2,1H3