(E)-2-cyano-3-(dimethylamino)-N-(2-morpholin-4-ium-4-ylethyl)but-2-enamide

Systemtic Name: (E)-2-cyano-3-(dimethylamino)-N-(2-morpholin-4-ium-4-ylethyl)but-2-enamide Openeye Name: (E)-2-cyano-3-(dimethylamino)-N-(2-morpholin-4-ium-4-ylethyl)but-2-enamide CAS Name: (E)-2-cyano-3-(dimethylamino)-N-[2-(4-morpholin-4-iumyl)ethyl]-2-butenamide IUPAC Name: (E)-2-cyano-3-(dimethylamino)-N-(2-morpholin-4-ium-4-ylethyl)but-2-enamide Traditional Name: (E)-2-cyano-3-(dimethylamino)-N-(2-morpholin-4-ium-4-ylethyl)but-2-enamide Formula: C13H23N4O2+ MolecularWeight: 267.34732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)NCC[NH+]1CCOCC1)N(C)C

Isomeric SMILES

C/C(=C(/C#N)\C(=O)NCC[NH+]1CCOCC1)/N(C)C

InChI

InChI=1S/C13H22N4O2/c1-11(16(2)3)12(10-14)13(18)15-4-5-17-6-8-19-9-7-17/h4-9H2,1-3H3,(H,15,18)/p+1/b12-11+