2-[(2,4-dimethylphenyl)methyl]-5-fluoranyl-3-(4-phenoxyphenyl)isoquinolin-1-one

Systemtic Name: 2-[(2,4-dimethylphenyl)methyl]-5-fluoranyl-3-(4-phenoxyphenyl)isoquinolin-1-one Openeye Name: 2-[(2,4-dimethylphenyl)methyl]-5-fluoro-3-(4-phenoxyphenyl)isoquinolin-1-one CAS Name: 2-[(2,4-dimethylphenyl)methyl]-5-fluoro-3-(4-phenoxyphenyl)-1-isoquinolinone IUPAC Name: 2-[(2,4-dimethylphenyl)methyl]-5-fluoro-3-(4-phenoxyphenyl)isoquinolin-1-one Traditional Name: 2-(2,4-dimethylbenzyl)-5-fluoro-3-(4-phenoxyphenyl)isocarbostyril Formula: C30H24FNO2 MolecularWeight: 449.515463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN2C(=CC3=C(C2=O)C=CC=C3F)C4=CC=C(C=C4)OC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN2C(=CC3=C(C2=O)C=CC=C3F)C4=CC=C(C=C4)OC5=CC=CC=C5)C

InChI

InChI=1S/C30H24FNO2/c1-20-11-12-23(21(2)17-20)19-32-29(18-27-26(30(32)33)9-6-10-28(27)31)22-13-15-25(16-14-22)34-24-7-4-3-5-8-24/h3-18H,19H2,1-2H3