2-[1-(methoxymethyl)pyrazol-4-yl]-3,5,6-trimethyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-[1-(methoxymethyl)pyrazol-4-yl]-3,5,6-trimethyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-[1-(methoxymethyl)pyrazol-4-yl]-3,5,6-trimethyl-1,4-benzoquinone CAS Name: 2-[1-(methoxymethyl)-4-pyrazolyl]-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-[1-(methoxymethyl)pyrazol-4-yl]-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-[1-(methoxymethyl)pyrazol-4-yl]-3,5,6-trimethyl-p-benzoquinone Formula: C14H16N2O3 MolecularWeight: 260.28844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C)C2=CN(N=C2)COC)C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C)C2=CN(N=C2)COC)C

InChI

InChI=1S/C14H16N2O3/c1-8-9(2)14(18)12(10(3)13(8)17)11-5-15-16(6-11)7-19-4/h5-6H,7H2,1-4H3