5-ethanoyl-6-methyl-2-pyrrolidin-1-yl-pyridin-1-ium-3-carbonitrile

Systemtic Name: 5-ethanoyl-6-methyl-2-pyrrolidin-1-yl-pyridin-1-ium-3-carbonitrile Openeye Name: 5-acetyl-6-methyl-2-pyrrolidin-1-yl-pyridin-1-ium-3-carbonitrile CAS Name: 5-acetyl-6-methyl-2-(1-pyrrolidinyl)-3-pyridin-1-iumcarbonitrile IUPAC Name: 5-acetyl-6-methyl-2-pyrrolidin-1-ylpyridin-1-ium-3-carbonitrile Traditional Name: 5-acetyl-6-methyl-2-pyrrolidino-pyridin-1-ium-3-carbonitrile Formula: C13H16N3O+ MolecularWeight: 230.28564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=[NH+]1)N2CCCC2)C#N)C(=O)C

Isomeric SMILES

CC1=C(C=C(C(=[NH+]1)N2CCCC2)C#N)C(=O)C

InChI

InChI=1S/C13H15N3O/c1-9-12(10(2)17)7-11(8-14)13(15-9)16-5-3-4-6-16/h7H,3-6H2,1-2H3/p+1