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

Systemtic Name: tert-butyl 4-[3-[4-(dioxidanyl)-6-[2-(methylamino)ethanoyl]cyclohexa-1,5-dien-1-yl]-3-oxidanylidene-propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-[4-hydroperoxy-6-[2-(methylamino)acetyl]cyclohexa-1,5-dien-1-yl]-3-oxo-propyl]piperidine-1-carboxylate CAS Name: 4-[3-[4-hydroperoxy-6-[2-(methylamino)-1-oxoethyl]-1-cyclohexa-1,5-dienyl]-3-oxopropyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-[4-hydroperoxy-6-[2-(methylamino)acetyl]cyclohexa-1,5-dien-1-yl]-3-oxopropyl]piperidine-1-carboxylate Traditional Name: 4-[3-(4-hydroperoxy-6-sarcosyl-cyclohexa-1,5-dien-1-yl)-3-keto-propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H34N2O6 MolecularWeight: 422.51516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCC(=O)C2=CCC(C=C2C(=O)CNC)OO

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCC(=O)C2=CCC(C=C2C(=O)CNC)OO

InChI

InChI=1S/C22H34N2O6/c1-22(2,3)29-21(27)24-11-9-15(10-12-24)5-8-19(25)17-7-6-16(30-28)13-18(17)20(26)14-23-4/h7,13,15-16,23,28H,5-6,8-12,14H2,1-4H3