(3aS,4R,7aR)-3a,7a-bis(chloranyl)-5-ethenyl-2-(4-fluorophenyl)-4-(4-methoxy-3-oxidanyl-phenyl)-4,7-dihydroisoindole-1,3-dione

Systemtic Name: (3aS,4R,7aR)-3a,7a-bis(chloranyl)-5-ethenyl-2-(4-fluorophenyl)-4-(4-methoxy-3-oxidanyl-phenyl)-4,7-dihydroisoindole-1,3-dione Openeye Name: (3aS,4R,7aR)-3a,7a-dichloro-2-(4-fluorophenyl)-4-(3-hydroxy-4-methoxy-phenyl)-5-vinyl-4,7-dihydroisoindole-1,3-dione CAS Name: (3aS,4R,7aR)-3a,7a-dichloro-5-ethenyl-2-(4-fluorophenyl)-4-(3-hydroxy-4-methoxyphenyl)-4,7-dihydroisoindole-1,3-dione IUPAC Name: (3aS,4R,7aR)-3a,7a-dichloro-5-ethenyl-2-(4-fluorophenyl)-4-(3-hydroxy-4-methoxyphenyl)-4,7-dihydroisoindole-1,3-dione Traditional Name: (3aS,4R,7aR)-3a,7a-dichloro-2-(4-fluorophenyl)-4-(3-hydroxy-4-methoxy-phenyl)-5-vinyl-4,7-dihydroisoindole-1,3-quinone Formula: C23H18Cl2FNO4 MolecularWeight: 462.297723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=CCC3(C2(C(=O)N(C3=O)C4=CC=C(C=C4)F)Cl)Cl)C=C)O

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2C(=CC[C@@]3([C@]2(C(=O)N(C3=O)C4=CC=C(C=C4)F)Cl)Cl)C=C)O

InChI

InChI=1S/C23H18Cl2FNO4/c1-3-13-10-11-22(24)20(29)27(16-7-5-15(26)6-8-16)21(30)23(22,25)19(13)14-4-9-18(31-2)17(28)12-14/h3-10,12,19,28H,1,11H2,2H3/t19-,22-,23+/m1/s1