tert-butyl 4-[4-[2,3-ditert-butyl-4-(dioxidanyl)-6-ethanoyl-cyclohexa-1,5-dien-1-yl]piperazin-1-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[2,3-ditert-butyl-4-(dioxidanyl)-6-ethanoyl-cyclohexa-1,5-dien-1-yl]piperazin-1-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(6-acetyl-2,3-ditert-butyl-4-hydroperoxy-cyclohexa-1,5-dien-1-yl)piperazin-1-yl]piperidine-1-carboxylate CAS Name: 4-[4-(6-acetyl-2,3-ditert-butyl-4-hydroperoxy-1-cyclohexa-1,5-dienyl)-1-piperazinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(6-acetyl-2,3-ditert-butyl-4-hydroperoxycyclohexa-1,5-dien-1-yl)piperazin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(6-acetyl-2,3-ditert-butyl-4-hydroperoxy-cyclohexa-1,5-dien-1-yl)piperazino]piperidine-1-carboxylic acid tert-butyl ester Formula: C30H51N3O5 MolecularWeight: 533.74304

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(C(C(=C1N2CCN(CC2)C3CCN(CC3)C(=O)OC(C)(C)C)C(C)(C)C)C(C)(C)C)OO

Isomeric SMILES

CC(=O)C1=CC(C(C(=C1N2CCN(CC2)C3CCN(CC3)C(=O)OC(C)(C)C)C(C)(C)C)C(C)(C)C)OO

InChI

InChI=1S/C30H51N3O5/c1-20(34)22-19-23(38-36)24(28(2,3)4)25(29(5,6)7)26(22)32-17-15-31(16-18-32)21-11-13-33(14-12-21)27(35)37-30(8,9)10/h19,21,23-24,36H,11-18H2,1-10H3