1-prop-1-en-2-ylpyridin-1-ium sulfate

Systemtic Name: 1-prop-1-en-2-ylpyridin-1-ium sulfate Openeye Name: 1-isopropenylpyridin-1-ium sulfate CAS Name: 1-(1-methylethenyl)pyridin-1-ium sulfate IUPAC Name: 1-prop-1-en-2-ylpyridin-1-ium sulfate Traditional Name: 1-isopropenylpyridin-1-ium sulfate Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)[N+]1=CC=CC=C1.CC(=C)[N+]1=CC=CC=C1.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC(=C)[N+]1=CC=CC=C1.CC(=C)[N+]1=CC=CC=C1.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C8H10N.H2O4S/c2*1-8(2)9-6-4-3-5-7-9;1-5(2,3)4/h2*3-7H,1H2,2H3;(H2,1,2,3,4)/q2*+1;/p-2