4-methyl-5-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-6-oxidanyl-2-oxidanylidene-1-prop-2-enyl-pyridine-3-carbonitrile

Systemtic Name: 4-methyl-5-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-6-oxidanyl-2-oxidanylidene-1-prop-2-enyl-pyridine-3-carbonitrile Openeye Name: 1-allyl-6-hydroxy-4-methyl-5-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-2-oxo-pyridine-3-carbonitrile CAS Name: 6-hydroxy-4-methyl-5-[[(3R)-3-methyl-1-piperidin-1-iumyl]methyl]-2-oxo-1-prop-2-enyl-3-pyridinecarbonitrile IUPAC Name: 6-hydroxy-4-methyl-5-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]-2-oxo-1-prop-2-enylpyridine-3-carbonitrile Traditional Name: 1-allyl-6-hydroxy-2-keto-4-methyl-5-[[(3R)-3-methylpiperidin-1-ium-1-yl]methyl]nicotinonitrile Formula: C17H24N3O2+ MolecularWeight: 302.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=C(N(C(=O)C(=C2C)C#N)CC=C)O

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CC2=C(N(C(=O)C(=C2C)C#N)CC=C)O

InChI

InChI=1S/C17H23N3O2/c1-4-7-20-16(21)14(9-18)13(3)15(17(20)22)11-19-8-5-6-12(2)10-19/h4,12,22H,1,5-8,10-11H2,2-3H3/p+1/t12-/m1/s1