3-(2-tert-butyl-3-oxidanylidene-5-propan-2-yl-1H-pyrazol-4-yl)-4-oxidanyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(2-tert-butyl-3-oxidanylidene-5-propan-2-yl-1H-pyrazol-4-yl)-4-oxidanyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-(2-tert-butyl-5-isopropyl-3-oxo-1H-pyrazol-4-yl)-4-hydroxy-cyclobut-3-ene-1,2-dione CAS Name: 3-(2-tert-butyl-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl)-4-hydroxycyclobut-3-ene-1,2-dione IUPAC Name: 3-(2-tert-butyl-3-oxo-5-propan-2-yl-1H-pyrazol-4-yl)-4-hydroxycyclobut-3-ene-1,2-dione Traditional Name: 3-(1-tert-butyl-3-isopropyl-5-keto-3-pyrazolin-4-yl)-4-hydroxy-cyclobut-3-ene-1,2-quinone Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=O)N(N1)C(C)(C)C)C2=C(C(=O)C2=O)O

Isomeric SMILES

CC(C)C1=C(C(=O)N(N1)C(C)(C)C)C2=C(C(=O)C2=O)O

InChI

InChI=1S/C14H18N2O4/c1-6(2)9-7(8-10(17)12(19)11(8)18)13(20)16(15-9)14(3,4)5/h6,15,17H,1-5H3