2-ethanimidoyl-3-oxidanylidene-4-piperidin-1-ium-1-yl-butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-piperidin-1-ium-1-yl-butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-piperidin-1-ium-1-yl-butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-(1-piperidin-1-iumyl)butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-piperidin-1-ium-1-ylbutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-piperidin-1-ium-1-yl-butyronitrile Formula: C11H18N3O+ MolecularWeight: 208.28012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)C[NH+]1CCCCC1

Isomeric SMILES

CC(=N)C(C#N)C(=O)C[NH+]1CCCCC1

InChI

InChI=1S/C11H17N3O/c1-9(13)10(7-12)11(15)8-14-5-3-2-4-6-14/h10,13H,2-6,8H2,1H3/p+1