5-ethynyl-1-methyl-6-(morpholin-4-ylmethyl)-7-(2-oxidanylcyclopentyl)-4-oxidanylidene-cinnoline-3-carboxamide

Systemtic Name: 5-ethynyl-1-methyl-6-(morpholin-4-ylmethyl)-7-(2-oxidanylcyclopentyl)-4-oxidanylidene-cinnoline-3-carboxamide Openeye Name: 5-ethynyl-7-(2-hydroxycyclopentyl)-1-methyl-6-(morpholinomethyl)-4-oxo-cinnoline-3-carboxamide CAS Name: 5-ethynyl-7-(2-hydroxycyclopentyl)-1-methyl-6-(4-morpholinylmethyl)-4-oxo-3-cinnolinecarboxamide IUPAC Name: 5-ethynyl-7-(2-hydroxycyclopentyl)-1-methyl-6-(morpholin-4-ylmethyl)-4-oxocinnoline-3-carboxamide Traditional Name: 5-ethynyl-7-(2-hydroxycyclopentyl)-4-keto-1-methyl-6-(morpholinomethyl)cinnoline-3-carboxamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=C(C(=C2)C3CCCC3O)CN4CCOCC4)C#C)C(=O)C(=N1)C(=O)N

Isomeric SMILES

CN1C2=C(C(=C(C(=C2)C3CCCC3O)CN4CCOCC4)C#C)C(=O)C(=N1)C(=O)N

InChI

InChI=1S/C22H26N4O4/c1-3-13-16(12-26-7-9-30-10-8-26)15(14-5-4-6-18(14)27)11-17-19(13)21(28)20(22(23)29)24-25(17)2/h1,11,14,18,27H,4-10,12H2,2H3,(H2,23,29)