2,3,5-trimethyl-6-[phenyl(pyridin-3-yl)methyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,3,5-trimethyl-6-[phenyl(pyridin-3-yl)methyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,3,5-trimethyl-6-[phenyl(3-pyridyl)methyl]-1,4-benzoquinone CAS Name: 2,3,5-trimethyl-6-[phenyl(3-pyridinyl)methyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,3,5-trimethyl-6-[phenyl(pyridin-3-yl)methyl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2,3,5-trimethyl-6-[phenyl(3-pyridyl)methyl]-p-benzoquinone Formula: C21H19NO2 MolecularWeight: 317.38106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C)C(C2=CC=CC=C2)C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C)C(C2=CC=CC=C2)C3=CN=CC=C3)C

InChI

InChI=1S/C21H19NO2/c1-13-14(2)21(24)18(15(3)20(13)23)19(16-8-5-4-6-9-16)17-10-7-11-22-12-17/h4-12,19H,1-3H3