N-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]azepane-1-carboxamide

Systemtic Name: N-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]azepane-1-carboxamide Openeye Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]azepane-1-carboxamide CAS Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-1-azepanecarboxamide IUPAC Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]azepane-1-carboxamide Traditional Name: N-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]azepane-1-carboxamide Formula: C29H42N2O2 MolecularWeight: 450.65598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2NC(=O)N3CCCCCC3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2NC(=O)N3CCCCCC3

InChI

InChI=1S/C29H42N2O2/c1-28(2,3)23-19-21(20-24(26(23)32)29(4,5)6)15-16-22-13-9-10-14-25(22)30-27(33)31-17-11-7-8-12-18-31/h9-10,13-14,19-20,32H,7-8,11-12,15-18H2,1-6H3,(H,30,33)