5-but-1-ynyl-1-methyl-6-(morpholin-4-ylmethyl)-3-oxidanyl-4-oxidanylidene-2H-cinnoline-3-carboxamide

Systemtic Name: 5-but-1-ynyl-1-methyl-6-(morpholin-4-ylmethyl)-3-oxidanyl-4-oxidanylidene-2H-cinnoline-3-carboxamide Openeye Name: 5-but-1-ynyl-3-hydroxy-1-methyl-6-(morpholinomethyl)-4-oxo-2H-cinnoline-3-carboxamide CAS Name: 5-but-1-ynyl-3-hydroxy-1-methyl-6-(4-morpholinylmethyl)-4-oxo-2H-cinnoline-3-carboxamide IUPAC Name: 5-but-1-ynyl-3-hydroxy-1-methyl-6-(morpholin-4-ylmethyl)-4-oxo-2H-cinnoline-3-carboxamide Traditional Name: 5-but-1-ynyl-3-hydroxy-4-keto-1-methyl-6-(morpholinomethyl)-2H-cinnoline-3-carboxamide Formula: C19H24N4O4 MolecularWeight: 372.41826

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CC1=C(C=CC2=C1C(=O)C(NN2C)(C(=O)N)O)CN3CCOCC3

Isomeric SMILES

CCC#CC1=C(C=CC2=C1C(=O)C(NN2C)(C(=O)N)O)CN3CCOCC3

InChI

InChI=1S/C19H24N4O4/c1-3-4-5-14-13(12-23-8-10-27-11-9-23)6-7-15-16(14)17(24)19(26,18(20)25)21-22(15)2/h6-7,21,26H,3,8-12H2,1-2H3,(H2,20,25)