3-[(3S,6S)-1,3,6-trimethyl-4-oxidanylidene-piperidin-1-ium-3-yl]propanenitrile

Systemtic Name: 3-[(3S,6S)-1,3,6-trimethyl-4-oxidanylidene-piperidin-1-ium-3-yl]propanenitrile Openeye Name: 3-[(3S,6S)-1,3,6-trimethyl-4-oxo-piperidin-1-ium-3-yl]propanenitrile CAS Name: 3-[(3S,6S)-1,3,6-trimethyl-4-oxo-3-piperidin-1-iumyl]propanenitrile IUPAC Name: 3-[(3S,6S)-1,3,6-trimethyl-4-oxopiperidin-1-ium-3-yl]propanenitrile Traditional Name: 3-[(3S,6S)-4-keto-1,3,6-trimethyl-piperidin-1-ium-3-yl]propionitrile Formula: C11H19N2O+ MolecularWeight: 195.28136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C[NH+]1C)(C)CCC#N

Isomeric SMILES

C[C@H]1CC(=O)[C@@](C[NH+]1C)(C)CCC#N

InChI

InChI=1S/C11H18N2O/c1-9-7-10(14)11(2,5-4-6-12)8-13(9)3/h9H,4-5,7-8H2,1-3H3/p+1/t9-,11-/m0/s1