2-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-4-pyridin-3-ylcarbonyl-piperazine-1-carboxamide

Systemtic Name: 2-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-4-pyridin-3-ylcarbonyl-piperazine-1-carboxamide Openeye Name: 2-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-4-(pyridine-3-carbonyl)piperazine-1-carboxamide CAS Name: 2-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-4-[oxo(3-pyridinyl)methyl]-1-piperazinecarboxamide IUPAC Name: 2-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-4-(pyridine-3-carbonyl)piperazine-1-carboxamide Traditional Name: 2-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-4-nicotinoyl-piperazine-1-carboxamide Formula: C33H42N4O3 MolecularWeight: 542.71158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2C3CN(CCN3C(=O)N)C(=O)C4=CN=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2C3CN(CCN3C(=O)N)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C33H42N4O3/c1-32(2,3)26-18-22(19-27(29(26)38)33(4,5)6)13-14-23-10-7-8-12-25(23)28-21-36(16-17-37(28)31(34)40)30(39)24-11-9-15-35-20-24/h7-12,15,18-20,28,38H,13-14,16-17,21H2,1-6H3,(H2,34,40)