(3aR,7S,7aS)-2-(3-chloranyl-4-fluoranyl-phenyl)-6-ethenyl-7-[5-(hydroxymethyl)furan-2-yl]-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione

Systemtic Name: (3aR,7S,7aS)-2-(3-chloranyl-4-fluoranyl-phenyl)-6-ethenyl-7-[5-(hydroxymethyl)furan-2-yl]-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione Openeye Name: (3aR,7S,7aS)-2-(3-chloro-4-fluoro-phenyl)-7-[5-(hydroxymethyl)-2-furyl]-7a-methyl-6-vinyl-4,7-dihydro-3aH-isoindole-1,3-dione CAS Name: (3aR,7S,7aS)-2-(3-chloro-4-fluorophenyl)-6-ethenyl-7-[5-(hydroxymethyl)-2-furanyl]-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione IUPAC Name: (3aR,7S,7aS)-2-(3-chloro-4-fluorophenyl)-6-ethenyl-7-[5-(hydroxymethyl)furan-2-yl]-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione Traditional Name: (3aR,7S,7aS)-2-(3-chloro-4-fluoro-phenyl)-7a-methyl-7-(5-methylol-2-furyl)-6-vinyl-4,7-dihydro-3aH-isoindole-1,3-quinone Formula: C22H19ClFNO4 MolecularWeight: 415.841963

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Descriptors Computed from Structure

Canonical SMILES:

CC12C(CC=C(C1C3=CC=C(O3)CO)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(O3)CO)C=C)C(=O)N(C2=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H19ClFNO4/c1-3-12-4-7-15-20(27)25(13-5-8-17(24)16(23)10-13)21(28)22(15,2)19(12)18-9-6-14(11-26)29-18/h3-6,8-10,15,19,26H,1,7,11H2,2H3/t15-,19+,22+/m0/s1