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

Systemtic Name: (3aS,4R,7aR)-3a,7a-bis(chloranyl)-5-ethenyl-2-(4-fluorophenyl)-4-(3-hydroxyphenyl)-4,7-dihydroisoindole-1,3-dione Openeye Name: (3aS,4R,7aR)-3a,7a-dichloro-2-(4-fluorophenyl)-4-(3-hydroxyphenyl)-5-vinyl-4,7-dihydroisoindole-1,3-dione CAS Name: (3aS,4R,7aR)-3a,7a-dichloro-5-ethenyl-2-(4-fluorophenyl)-4-(3-hydroxyphenyl)-4,7-dihydroisoindole-1,3-dione IUPAC Name: (3aS,4R,7aR)-3a,7a-dichloro-5-ethenyl-2-(4-fluorophenyl)-4-(3-hydroxyphenyl)-4,7-dihydroisoindole-1,3-dione Traditional Name: (3aS,4R,7aR)-3a,7a-dichloro-2-(4-fluorophenyl)-4-(3-hydroxyphenyl)-5-vinyl-4,7-dihydroisoindole-1,3-quinone Formula: C22H16Cl2FNO3 MolecularWeight: 432.271743

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CCC2(C(=O)N(C(=O)C2(C1C3=CC(=CC=C3)O)Cl)C4=CC=C(C=C4)F)Cl

Isomeric SMILES

C=CC1=CC[C@]2(C(=O)N(C(=O)[C@]2([C@H]1C3=CC(=CC=C3)O)Cl)C4=CC=C(C=C4)F)Cl

InChI

InChI=1S/C22H16Cl2FNO3/c1-2-13-10-11-21(23)19(28)26(16-8-6-15(25)7-9-16)20(29)22(21,24)18(13)14-4-3-5-17(27)12-14/h2-10,12,18,27H,1,11H2/t18-,21-,22+/m1/s1