3-bromanyl-4-methyl-1-[(4-methylphenyl)methyl]pyrrole-2,5-dione

Systemtic Name: 3-bromanyl-4-methyl-1-[(4-methylphenyl)methyl]pyrrole-2,5-dione Openeye Name: 3-bromo-4-methyl-1-(p-tolylmethyl)pyrrole-2,5-dione CAS Name: 3-bromo-4-methyl-1-[(4-methylphenyl)methyl]pyrrole-2,5-dione IUPAC Name: 3-bromo-4-methyl-1-[(4-methylphenyl)methyl]pyrrole-2,5-dione Traditional Name: 3-bromo-4-methyl-1-(4-methylbenzyl)-3-pyrroline-2,5-quinone Formula: C13H12BrNO2 MolecularWeight: 294.14388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C(=C(C2=O)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C(=C(C2=O)Br)C

InChI

InChI=1S/C13H12BrNO2/c1-8-3-5-10(6-4-8)7-15-12(16)9(2)11(14)13(15)17/h3-6H,7H2,1-2H3