1-[3-[2,4-bis(2-methylbutan-2-yl)phenyl]-3-oxidanyl-propyl]-5-ethoxy-4-methyl-3H-pyridine-2,6-dione

Systemtic Name: 1-[3-[2,4-bis(2-methylbutan-2-yl)phenyl]-3-oxidanyl-propyl]-5-ethoxy-4-methyl-3H-pyridine-2,6-dione Openeye Name: 1-[3-[2,4-bis(1,1-dimethylpropyl)phenyl]-3-hydroxy-propyl]-5-ethoxy-4-methyl-3H-pyridine-2,6-dione CAS Name: 1-[3-[2,4-bis(2-methylbutan-2-yl)phenyl]-3-hydroxypropyl]-5-ethoxy-4-methyl-3H-pyridine-2,6-dione IUPAC Name: 1-[3-[2,4-bis(2-methylbutan-2-yl)phenyl]-3-hydroxypropyl]-5-ethoxy-4-methyl-3H-pyridine-2,6-dione Traditional Name: 1-[3-(2,4-ditert-amylphenyl)-3-hydroxy-propyl]-5-ethoxy-4-methyl-3H-pyridine-2,6-quinone Formula: C27H41NO4 MolecularWeight: 443.61874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)C(CCN2C(=O)CC(=C(C2=O)OCC)C)O)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)C(CCN2C(=O)CC(=C(C2=O)OCC)C)O)C(C)(C)CC

InChI

InChI=1S/C27H41NO4/c1-9-26(5,6)19-12-13-20(21(17-19)27(7,8)10-2)22(29)14-15-28-23(30)16-18(4)24(25(28)31)32-11-3/h12-13,17,22,29H,9-11,14-16H2,1-8H3