5-methylidene-1-(2,3,4,5,6-pentadeuteriophenyl)pyridin-1-ium-2-one

Systemtic Name: 5-methylidene-1-(2,3,4,5,6-pentadeuteriophenyl)pyridin-1-ium-2-one Openeye Name: 5-methylene-1-(2,3,4,5,6-pentadeuteriophenyl)pyridin-1-ium-2-one CAS Name: 5-methylene-1-(2,3,4,5,6-pentadeuteriophenyl)-2-pyridin-1-iumone IUPAC Name: 5-methylidene-1-(2,3,4,5,6-pentadeuteriophenyl)pyridin-1-ium-2-one Traditional Name: 5-methylene-1-(2,3,4,5,6-pentadeuteriophenyl)pyridin-1-ium-2-one Formula: C12H10NO+ MolecularWeight: 189.244709

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C=CC(=O)[N+](=C1)C2=CC=CC=C2

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1[2H])[2H])[N+]2=CC(=C)C=CC2=O)[2H])[2H]

InChI

InChI=1S/C12H10NO/c1-10-7-8-12(14)13(9-10)11-5-3-2-4-6-11/h2-9H,1H2/q+1/i2D,3D,4D,5D,6D