2-(4-chloranyl-2-fluoranyl-5-prop-2-ynoxy-phenyl)-6-methoxy-3-methylidene-isoindol-1-one

Systemtic Name: 2-(4-chloranyl-2-fluoranyl-5-prop-2-ynoxy-phenyl)-6-methoxy-3-methylidene-isoindol-1-one Openeye Name: 2-(4-chloro-2-fluoro-5-prop-2-ynoxy-phenyl)-6-methoxy-3-methylene-isoindolin-1-one CAS Name: 2-(4-chloro-2-fluoro-5-prop-2-ynoxyphenyl)-6-methoxy-3-methylene-1-isoindolone IUPAC Name: 2-(4-chloro-2-fluoro-5-prop-2-ynoxyphenyl)-6-methoxy-3-methylideneisoindol-1-one Traditional Name: 2-(4-chloro-2-fluoro-5-propargyloxy-phenyl)-6-methoxy-3-methylene-isoindolin-1-one Formula: C19H13ClFNO3 MolecularWeight: 357.762823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C)N(C2=O)C3=CC(=C(C=C3F)Cl)OCC#C

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C)N(C2=O)C3=CC(=C(C=C3F)Cl)OCC#C

InChI

InChI=1S/C19H13ClFNO3/c1-4-7-25-18-10-17(16(21)9-15(18)20)22-11(2)13-6-5-12(24-3)8-14(13)19(22)23/h1,5-6,8-10H,2,7H2,3H3