2-(4-tert-butylpyridin-1-ium-1-yl)-3,4-bis(oxidanylidene)cyclobuten-1-olate

Systemtic Name: 2-(4-tert-butylpyridin-1-ium-1-yl)-3,4-bis(oxidanylidene)cyclobuten-1-olate Openeye Name: 2-(4-tert-butylpyridin-1-ium-1-yl)-3,4-dioxo-cyclobuten-1-olate CAS Name: 2-(4-tert-butyl-1-pyridin-1-iumyl)-3,4-dioxo-1-cyclobutenolate IUPAC Name: 2-(4-tert-butylpyridin-1-ium-1-yl)-3,4-dioxocyclobuten-1-olate Traditional Name: 2-(4-tert-butylpyridin-1-ium-1-yl)-3,4-diketo-cyclobuten-1-olate Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO3/c1-13(2,3)8-4-6-14(7-5-8)9-10(15)12(17)11(9)16/h4-7H,1-3H3