N1-(4-ethynylphenyl)-N2-[2-fluoranyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]-4-prop-2-ynoxy-pyrrolidine-1,2-dicarboxamide

Systemtic Name: N1-(4-ethynylphenyl)-N2-[2-fluoranyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]-4-prop-2-ynoxy-pyrrolidine-1,2-dicarboxamide Openeye Name: N1-(4-ethynylphenyl)-N2-[2-fluoro-4-(3-oxomorpholin-4-yl)phenyl]-4-prop-2-ynoxy-pyrrolidine-1,2-dicarboxamide CAS Name: N1-(4-ethynylphenyl)-N2-[2-fluoro-4-(3-oxo-4-morpholinyl)phenyl]-4-prop-2-ynoxypyrrolidine-1,2-dicarboxamide IUPAC Name: 1-N-(4-ethynylphenyl)-2-N-[2-fluoro-4-(3-oxomorpholin-4-yl)phenyl]-4-prop-2-ynoxypyrrolidine-1,2-dicarboxamide Traditional Name: N-(4-ethynylphenyl)-N'-[2-fluoro-4-(3-ketomorpholino)phenyl]-4-propargyloxy-pyrrolidine-1,2-dicarboxamide Formula: C27H25FN4O5 MolecularWeight: 504.509603

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1CC(N(C1)C(=O)NC2=CC=C(C=C2)C#C)C(=O)NC3=C(C=C(C=C3)N4CCOCC4=O)F

Isomeric SMILES

C#CCOC1CC(N(C1)C(=O)NC2=CC=C(C=C2)C#C)C(=O)NC3=C(C=C(C=C3)N4CCOCC4=O)F

InChI

InChI=1S/C27H25FN4O5/c1-3-12-37-21-15-24(32(16-21)27(35)29-19-7-5-18(4-2)6-8-19)26(34)30-23-10-9-20(14-22(23)28)31-11-13-36-17-25(31)33/h1-2,5-10,14,21,24H,11-13,15-17H2,(H,29,35)(H,30,34)