1-azanyl-4,4-dimethyl-1-pyridin-1-ium-3-yl-pent-1-en-3-one

Systemtic Name: 1-azanyl-4,4-dimethyl-1-pyridin-1-ium-3-yl-pent-1-en-3-one Openeye Name: 1-amino-4,4-dimethyl-1-pyridin-1-ium-3-yl-pent-1-en-3-one CAS Name: 1-amino-4,4-dimethyl-1-(3-pyridin-1-iumyl)-1-penten-3-one IUPAC Name: 1-amino-4,4-dimethyl-1-pyridin-1-ium-3-ylpent-1-en-3-one Traditional Name: 1-amino-4,4-dimethyl-1-pyridin-1-ium-3-yl-pent-1-en-3-one Formula: C12H17N2O+ MolecularWeight: 205.27618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C=C(C1=C[NH+]=CC=C1)N

Isomeric SMILES

CC(C)(C)C(=O)C=C(C1=C[NH+]=CC=C1)N

InChI

InChI=1S/C12H16N2O/c1-12(2,3)11(15)7-10(13)9-5-4-6-14-8-9/h4-8H,13H2,1-3H3/p+1