1-(2-dimethylaminoethyl)-4-[(3-fluoranyl-4-propan-2-yloxy-phenyl)-oxidanyl-methylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione

Systemtic Name: 1-(2-dimethylaminoethyl)-4-[(3-fluoranyl-4-propan-2-yloxy-phenyl)-oxidanyl-methylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione Openeye Name: 1-(2-dimethylaminoethyl)-4-[(3-fluoro-4-isopropoxy-phenyl)-hydroxy-methylene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione CAS Name: 1-(2-dimethylaminoethyl)-4-[(3-fluoro-4-propan-2-yloxyphenyl)-hydroxymethylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione IUPAC Name: 1-(2-dimethylaminoethyl)-4-[(3-fluoro-4-propan-2-yloxyphenyl)-hydroxymethylidene]-5-(3-methoxyphenyl)pyrrolidine-2,3-dione Traditional Name: 1-(2-dimethylaminoethyl)-4-[(3-fluoro-4-isopropoxy-phenyl)-hydroxy-methylene]-5-(3-methoxyphenyl)pyrrolidine-2,3-quinone Formula: C25H29FN2O5 MolecularWeight: 456.506563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC(=CC=C3)OC)O)F

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC(=CC=C3)OC)O)F

InChI

InChI=1S/C25H29FN2O5/c1-15(2)33-20-10-9-17(14-19(20)26)23(29)21-22(16-7-6-8-18(13-16)32-5)28(12-11-27(3)4)25(31)24(21)30/h6-10,13-15,22,29H,11-12H2,1-5H3