N-[[(2R)-5-fluoranyl-7-(4-fluoranyl-3-methyl-phenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[[(2R)-5-fluoranyl-7-(4-fluoranyl-3-methyl-phenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[[(2R)-5-fluoro-7-(4-fluoro-3-methyl-phenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[[(2R)-5-fluoro-7-(4-fluoro-3-methylphenyl)-2,3-dihydrobenzofuran-2-yl]methyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[[(2R)-5-fluoro-7-(4-fluoro-3-methylphenyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[[(2R)-5-fluoro-7-(4-fluoro-3-methyl-phenyl)coumaran-2-yl]methyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C26H21F2N3O3 MolecularWeight: 461.460046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=CC3=C2OC(C3)CNC(=O)C4=NN(C(=O)C5=CC=CC=C54)C)F)F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=CC3=C2O[C@H](C3)CNC(=O)C4=NN(C(=O)C5=CC=CC=C54)C)F)F

InChI

InChI=1S/C26H21F2N3O3/c1-14-9-15(7-8-22(14)28)21-12-17(27)10-16-11-18(34-24(16)21)13-29-25(32)23-19-5-3-4-6-20(19)26(33)31(2)30-23/h3-10,12,18H,11,13H2,1-2H3,(H,29,32)/t18-/m1/s1