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

Systemtic Name: N1-(4-ethynylphenyl)-N2-[3-methyl-4-(3-oxidanylidenemorpholin-4-yl)phenyl]pyrrolidine-1,2-dicarboxamide Openeye Name: N1-(4-ethynylphenyl)-N2-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]pyrrolidine-1,2-dicarboxamide CAS Name: N1-(4-ethynylphenyl)-N2-[3-methyl-4-(3-oxo-4-morpholinyl)phenyl]pyrrolidine-1,2-dicarboxamide IUPAC Name: 1-N-(4-ethynylphenyl)-2-N-[3-methyl-4-(3-oxomorpholin-4-yl)phenyl]pyrrolidine-1,2-dicarboxamide Traditional Name: N-(4-ethynylphenyl)-N'-[4-(3-ketomorpholino)-3-methyl-phenyl]pyrrolidine-1,2-dicarboxamide Formula: C25H26N4O4 MolecularWeight: 446.49834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2CCCN2C(=O)NC3=CC=C(C=C3)C#C)N4CCOCC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2CCCN2C(=O)NC3=CC=C(C=C3)C#C)N4CCOCC4=O

InChI

InChI=1S/C25H26N4O4/c1-3-18-6-8-19(9-7-18)27-25(32)29-12-4-5-22(29)24(31)26-20-10-11-21(17(2)15-20)28-13-14-33-16-23(28)30/h1,6-11,15,22H,4-5,12-14,16H2,2H3,(H,26,31)(H,27,32)