(3aR,7R,7aS)-2-(3-chloranyl-4-fluoranyl-phenyl)-6-ethenyl-7-[4-(2-hydroxyethyloxy)phenyl]-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione

Systemtic Name: (3aR,7R,7aS)-2-(3-chloranyl-4-fluoranyl-phenyl)-6-ethenyl-7-[4-(2-hydroxyethyloxy)phenyl]-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione Openeye Name: (3aR,7R,7aS)-2-(3-chloro-4-fluoro-phenyl)-7-[4-(2-hydroxyethoxy)phenyl]-7a-methyl-6-vinyl-4,7-dihydro-3aH-isoindole-1,3-dione CAS Name: (3aR,7R,7aS)-2-(3-chloro-4-fluorophenyl)-6-ethenyl-7-[4-(2-hydroxyethoxy)phenyl]-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione IUPAC Name: (3aR,7R,7aS)-2-(3-chloro-4-fluorophenyl)-6-ethenyl-7-[4-(2-hydroxyethoxy)phenyl]-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione Traditional Name: (3aR,7R,7aS)-2-(3-chloro-4-fluoro-phenyl)-7-[4-(2-hydroxyethoxy)phenyl]-7a-methyl-6-vinyl-4,7-dihydro-3aH-isoindole-1,3-quinone Formula: C25H23ClFNO4 MolecularWeight: 455.905823

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Descriptors Computed from Structure

Canonical SMILES:

CC12C(CC=C(C1C3=CC=C(C=C3)OCCO)C=C)C(=O)N(C2=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C[C@@]12[C@@H](CC=C([C@@H]1C3=CC=C(C=C3)OCCO)C=C)C(=O)N(C2=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C25H23ClFNO4/c1-3-15-6-10-19-23(30)28(17-7-11-21(27)20(26)14-17)24(31)25(19,2)22(15)16-4-8-18(9-5-16)32-13-12-29/h3-9,11,14,19,22,29H,1,10,12-13H2,2H3/t19-,22+,25+/m0/s1