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

Systemtic Name: (3aR,7R,7aS)-2-(3-chloranyl-4-fluoranyl-phenyl)-6-ethenyl-7a-methyl-7-(4-oxidanylnaphthalen-1-yl)-4,7-dihydro-3aH-isoindole-1,3-dione Openeye Name: (3aR,7R,7aS)-2-(3-chloro-4-fluoro-phenyl)-7-(4-hydroxy-1-naphthyl)-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-hydroxy-1-naphthalenyl)-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione IUPAC Name: (3aR,7R,7aS)-2-(3-chloro-4-fluorophenyl)-6-ethenyl-7-(4-hydroxynaphthalen-1-yl)-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione Traditional Name: (3aR,7R,7aS)-2-(3-chloro-4-fluoro-phenyl)-7-(4-hydroxy-1-naphthyl)-7a-methyl-6-vinyl-4,7-dihydro-3aH-isoindole-1,3-quinone Formula: C27H21ClFNO3 MolecularWeight: 461.911943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12C(CC=C(C1C3=CC=C(C4=CC=CC=C34)O)C=C)C(=O)N(C2=O)C5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C[C@@]12[C@@H](CC=C([C@@H]1C3=CC=C(C4=CC=CC=C34)O)C=C)C(=O)N(C2=O)C5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C27H21ClFNO3/c1-3-15-8-11-20-25(32)30(16-9-12-22(29)21(28)14-16)26(33)27(20,2)24(15)19-10-13-23(31)18-7-5-4-6-17(18)19/h3-10,12-14,20,24,31H,1,11H2,2H3/t20-,24+,27+/m0/s1