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

Systemtic Name: 1-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propyl]-5-ethanoyl-4-methyl-3H-pyridine-2,6-dione Openeye Name: 5-acetyl-1-[3-[2,4-bis(1,1-dimethylpropyl)phenoxy]propyl]-4-methyl-3H-pyridine-2,6-dione CAS Name: 5-acetyl-1-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propyl]-4-methyl-3H-pyridine-2,6-dione IUPAC Name: 5-acetyl-1-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propyl]-4-methyl-3H-pyridine-2,6-dione Traditional Name: 5-acetyl-1-[3-(2,4-ditert-amylphenoxy)propyl]-4-methyl-3H-pyridine-2,6-quinone Formula: C27H39NO4 MolecularWeight: 441.60286

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCN2C(=O)CC(=C(C2=O)C(=O)C)C)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCN2C(=O)CC(=C(C2=O)C(=O)C)C)C(C)(C)CC

InChI

InChI=1S/C27H39NO4/c1-9-26(5,6)20-12-13-22(21(17-20)27(7,8)10-2)32-15-11-14-28-23(30)16-18(3)24(19(4)29)25(28)31/h12-13,17H,9-11,14-16H2,1-8H3