4-[2-[4-(2-morpholin-4-ium-4-ylethanoyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[4-(2-morpholin-4-ium-4-ylethanoyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[4-(2-morpholin-4-ium-4-ylacetyl)piperazin-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 4-[2-[4-[2-(4-morpholin-4-iumyl)-1-oxoethyl]-1-piperazinyl]-2-oxoethoxy]benzonitrile IUPAC Name: 4-[2-[4-(2-morpholin-4-ium-4-ylacetyl)piperazin-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 4-[2-keto-2-[4-(2-morpholin-4-ium-4-ylacetyl)piperazino]ethoxy]benzonitrile Formula: C19H25N4O4+ MolecularWeight: 373.4262

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C#N

Isomeric SMILES

C1COCC[NH+]1CC(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H24N4O4/c20-13-16-1-3-17(4-2-16)27-15-19(25)23-7-5-22(6-8-23)18(24)14-21-9-11-26-12-10-21/h1-4H,5-12,14-15H2/p+1