1-[(2,5-dimethylphenyl)methyl]-4-phenethyl-pyrazine-2,3-dione

Systemtic Name: 1-[(2,5-dimethylphenyl)methyl]-4-phenethyl-pyrazine-2,3-dione Openeye Name: 1-[(2,5-dimethylphenyl)methyl]-4-phenethyl-pyrazine-2,3-dione CAS Name: 1-[(2,5-dimethylphenyl)methyl]-4-phenethylpyrazine-2,3-dione IUPAC Name: 1-[(2,5-dimethylphenyl)methyl]-4-phenethylpyrazine-2,3-dione Traditional Name: 1-(2,5-dimethylbenzyl)-4-phenethyl-pyrazine-2,3-quinone Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2C=CN(C(=O)C2=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2C=CN(C(=O)C2=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O2/c1-16-8-9-17(2)19(14-16)15-23-13-12-22(20(24)21(23)25)11-10-18-6-4-3-5-7-18/h3-9,12-14H,10-11,15H2,1-2H3