4-ethyl-8-[(4-fluoranyl-2,6-dimethyl-phenyl)amino]-2H-phthalazin-1-one

Systemtic Name: 4-ethyl-8-[(4-fluoranyl-2,6-dimethyl-phenyl)amino]-2H-phthalazin-1-one Openeye Name: 4-ethyl-8-(4-fluoro-2,6-dimethyl-anilino)-2H-phthalazin-1-one CAS Name: 4-ethyl-8-(4-fluoro-2,6-dimethylanilino)-2H-phthalazin-1-one IUPAC Name: 4-ethyl-8-(4-fluoro-2,6-dimethylanilino)-2H-phthalazin-1-one Traditional Name: 4-ethyl-8-(4-fluoro-2,6-dimethyl-anilino)-2H-phthalazin-1-one Formula: C18H18FN3O MolecularWeight: 311.353423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=O)C2=C1C=CC=C2NC3=C(C=C(C=C3C)F)C

Isomeric SMILES

CCC1=NNC(=O)C2=C1C=CC=C2NC3=C(C=C(C=C3C)F)C

InChI

InChI=1S/C18H18FN3O/c1-4-14-13-6-5-7-15(16(13)18(23)22-21-14)20-17-10(2)8-12(19)9-11(17)3/h5-9,20H,4H2,1-3H3,(H,22,23)