3-(4-tert-butylphenyl)-4-deuterio-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(4-tert-butylphenyl)-4-deuterio-cyclobut-3-ene-1,2-dione Openeye Name: 3-(4-tert-butylphenyl)-4-deuterio-cyclobut-3-ene-1,2-dione CAS Name: 3-(4-tert-butylphenyl)-4-deuteriocyclobut-3-ene-1,2-dione IUPAC Name: 3-(4-tert-butylphenyl)-4-deuteriocyclobut-3-ene-1,2-dione Traditional Name: 3-(4-tert-butylphenyl)-4-deuterio-cyclobut-3-ene-1,2-quinone Formula: C14H14O2 MolecularWeight: 215.265922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=O)C2=O

Isomeric SMILES

[2H]C1=C(C(=O)C1=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C14H14O2/c1-14(2,3)10-6-4-9(5-7-10)11-8-12(15)13(11)16/h4-8H,1-3H3/i8D