N-[1-(cyanomethylamino)-1-oxidanylidene-propan-2-yl]-4-morpholin-4-yl-benzamide

Systemtic Name: N-[1-(cyanomethylamino)-1-oxidanylidene-propan-2-yl]-4-morpholin-4-yl-benzamide Openeye Name: N-[2-(cyanomethylamino)-1-methyl-2-oxo-ethyl]-4-morpholino-benzamide CAS Name: N-[1-(cyanomethylamino)-1-oxopropan-2-yl]-4-(4-morpholinyl)benzamide IUPAC Name: N-[1-(cyanomethylamino)-1-oxopropan-2-yl]-4-morpholin-4-ylbenzamide Traditional Name: N-[2-(cyanomethylamino)-2-keto-1-methyl-ethyl]-4-morpholino-benzamide Formula: C16H20N4O3 MolecularWeight: 316.355

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC#N)NC(=O)C1=CC=C(C=C1)N2CCOCC2

Isomeric SMILES

CC(C(=O)NCC#N)NC(=O)C1=CC=C(C=C1)N2CCOCC2

InChI

InChI=1S/C16H20N4O3/c1-12(15(21)18-7-6-17)19-16(22)13-2-4-14(5-3-13)20-8-10-23-11-9-20/h2-5,12H,7-11H2,1H3,(H,18,21)(H,19,22)