1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propan-1-one

Systemtic Name: 1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propan-1-one Openeye Name: 1-[4-(azepane-1-carbonyl)-1-piperidyl]-3-(3,5-ditert-butyl-4-hydroxy-phenyl)propan-1-one CAS Name: 1-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-propanone IUPAC Name: 1-[4-(azepane-1-carbonyl)piperidin-1-yl]-3-(3,5-ditert-butyl-4-hydroxyphenyl)propan-1-one Traditional Name: 1-[4-(azepane-1-carbonyl)piperidino]-3-(3,5-ditert-butyl-4-hydroxy-phenyl)propan-1-one Formula: C29H46N2O3 MolecularWeight: 470.68714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)N2CCC(CC2)C(=O)N3CCCCCC3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)N2CCC(CC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C29H46N2O3/c1-28(2,3)23-19-21(20-24(26(23)33)29(4,5)6)11-12-25(32)30-17-13-22(14-18-30)27(34)31-15-9-7-8-10-16-31/h19-20,22,33H,7-18H2,1-6H3