3,5-dimethyl-2-[propan-2-yloxy(pyridin-3-yl)methyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 3,5-dimethyl-2-[propan-2-yloxy(pyridin-3-yl)methyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-[isopropoxy(3-pyridyl)methyl]-3,5-dimethyl-1,4-benzoquinone CAS Name: 3,5-dimethyl-2-[propan-2-yloxy(3-pyridinyl)methyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 3,5-dimethyl-2-[propan-2-yloxy(pyridin-3-yl)methyl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2-[isopropoxy(3-pyridyl)methyl]-3,5-dimethyl-p-benzoquinone Formula: C17H19NO3 MolecularWeight: 285.33766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(C1=O)C)C(C2=CN=CC=C2)OC(C)C

Isomeric SMILES

CC1=CC(=O)C(=C(C1=O)C)C(C2=CN=CC=C2)OC(C)C

InChI

InChI=1S/C17H19NO3/c1-10(2)21-17(13-6-5-7-18-9-13)15-12(4)16(20)11(3)8-14(15)19/h5-10,17H,1-4H3