3-[2-[[2-methoxy-4-(3-oxidanylidenebutyl)phenoxy]methyl]morpholin-4-yl]carbonylpyrazine-2-carboxamide

Systemtic Name: 3-[2-[[2-methoxy-4-(3-oxidanylidenebutyl)phenoxy]methyl]morpholin-4-yl]carbonylpyrazine-2-carboxamide Openeye Name: 3-[2-[[2-methoxy-4-(3-oxobutyl)phenoxy]methyl]morpholine-4-carbonyl]pyrazine-2-carboxamide CAS Name: 3-[[2-[[2-methoxy-4-(3-oxobutyl)phenoxy]methyl]-4-morpholinyl]-oxomethyl]-2-pyrazinecarboxamide IUPAC Name: 3-[2-[[2-methoxy-4-(3-oxobutyl)phenoxy]methyl]morpholine-4-carbonyl]pyrazine-2-carboxamide Traditional Name: 3-[2-[[4-(3-ketobutyl)-2-methoxy-phenoxy]methyl]morpholine-4-carbonyl]pyrazinamide Formula: C22H26N4O6 MolecularWeight: 442.46504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC(=C(C=C1)OCC2CN(CCO2)C(=O)C3=NC=CN=C3C(=O)N)OC

Isomeric SMILES

CC(=O)CCC1=CC(=C(C=C1)OCC2CN(CCO2)C(=O)C3=NC=CN=C3C(=O)N)OC

InChI

InChI=1S/C22H26N4O6/c1-14(27)3-4-15-5-6-17(18(11-15)30-2)32-13-16-12-26(9-10-31-16)22(29)20-19(21(23)28)24-7-8-25-20/h5-8,11,16H,3-4,9-10,12-13H2,1-2H3,(H2,23,28)