1-[2-fluoranyl-5-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]phenyl]-3,3-dimethyl-pyrrolidine-2,5-dione

Systemtic Name: 1-[2-fluoranyl-5-[(4-oxidanylidene-3H-phthalazin-1-yl)methyl]phenyl]-3,3-dimethyl-pyrrolidine-2,5-dione Openeye Name: 1-[2-fluoro-5-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]-3,3-dimethyl-pyrrolidine-2,5-dione CAS Name: 1-[2-fluoro-5-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]-3,3-dimethylpyrrolidine-2,5-dione IUPAC Name: 1-[2-fluoro-5-[(4-oxo-3H-phthalazin-1-yl)methyl]phenyl]-3,3-dimethylpyrrolidine-2,5-dione Traditional Name: 1-[2-fluoro-5-[(4-keto-3H-phthalazin-1-yl)methyl]phenyl]-3,3-dimethyl-pyrrolidine-2,5-quinone Formula: C21H18FN3O3 MolecularWeight: 379.384323

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(C1=O)C2=C(C=CC(=C2)CC3=NNC(=O)C4=CC=CC=C43)F)C

Isomeric SMILES

CC1(CC(=O)N(C1=O)C2=C(C=CC(=C2)CC3=NNC(=O)C4=CC=CC=C43)F)C

InChI

InChI=1S/C21H18FN3O3/c1-21(2)11-18(26)25(20(21)28)17-10-12(7-8-15(17)22)9-16-13-5-3-4-6-14(13)19(27)24-23-16/h3-8,10H,9,11H2,1-2H3,(H,24,27)