4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-[(4-iodophenyl)methoxymethyl]-3H-pyridine-2,6-dione

Systemtic Name: 4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-[(4-iodophenyl)methoxymethyl]-3H-pyridine-2,6-dione Openeye Name: 4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-[(4-iodophenyl)methoxymethyl]-3H-pyridine-2,6-dione CAS Name: 4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-[(4-iodophenyl)methoxymethyl]-3H-pyridine-2,6-dione IUPAC Name: 4-[(3,5-dimethylphenyl)methyl]-5-ethyl-3-[(4-iodophenyl)methoxymethyl]-3H-pyridine-2,6-dione Traditional Name: 4-(3,5-dimethylbenzyl)-5-ethyl-3-[(4-iodobenzyl)oxymethyl]-3H-pyridine-2,6-quinone Formula: C24H26INO3 MolecularWeight: 503.37261

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C(=O)NC1=O)COCC2=CC=C(C=C2)I)CC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCC1=C(C(C(=O)NC1=O)COCC2=CC=C(C=C2)I)CC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C24H26INO3/c1-4-20-21(12-18-10-15(2)9-16(3)11-18)22(24(28)26-23(20)27)14-29-13-17-5-7-19(25)8-6-17/h5-11,22H,4,12-14H2,1-3H3,(H,26,27,28)