4,4-bis[(3-fluoranyl-4-methoxy-phenyl)methyl]-2-(2-methylphenyl)isoquinoline-1,3-dione

Systemtic Name: 4,4-bis[(3-fluoranyl-4-methoxy-phenyl)methyl]-2-(2-methylphenyl)isoquinoline-1,3-dione Openeye Name: 4,4-bis[(3-fluoro-4-methoxy-phenyl)methyl]-2-(o-tolyl)isoquinoline-1,3-dione CAS Name: 4,4-bis[(3-fluoro-4-methoxyphenyl)methyl]-2-(2-methylphenyl)isoquinoline-1,3-dione IUPAC Name: 4,4-bis[(3-fluoro-4-methoxyphenyl)methyl]-2-(2-methylphenyl)isoquinoline-1,3-dione Traditional Name: 4,4-bis(3-fluoro-4-methoxy-benzyl)-2-(o-tolyl)isoquinoline-1,3-quinone Formula: C32H27F2NO4 MolecularWeight: 527.557886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C(C2=O)(CC4=CC(=C(C=C4)OC)F)CC5=CC(=C(C=C5)OC)F

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3C(C2=O)(CC4=CC(=C(C=C4)OC)F)CC5=CC(=C(C=C5)OC)F

InChI

InChI=1S/C32H27F2NO4/c1-20-8-4-7-11-27(20)35-30(36)23-9-5-6-10-24(23)32(31(35)37,18-21-12-14-28(38-2)25(33)16-21)19-22-13-15-29(39-3)26(34)17-22/h4-17H,18-19H2,1-3H3