2-[4-[[5-tert-butyl-2,3-bis(oxidanyl)phenyl]methyl]piperazin-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[[5-tert-butyl-2,3-bis(oxidanyl)phenyl]methyl]piperazin-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[(5-tert-butyl-2,3-dihydroxy-phenyl)methyl]piperazin-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[(5-tert-butyl-2,3-dihydroxyphenyl)methyl]-1-piperazinyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[(5-tert-butyl-2,3-dihydroxyphenyl)methyl]piperazin-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-(5-tert-butyl-2,3-dihydroxy-benzyl)piperazino]-1-piperidino-ethanone Formula: C22H35N3O3 MolecularWeight: 389.5316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)O)O)CN2CCN(CC2)CC(=O)N3CCCCC3

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)O)O)CN2CCN(CC2)CC(=O)N3CCCCC3

InChI

InChI=1S/C22H35N3O3/c1-22(2,3)18-13-17(21(28)19(26)14-18)15-23-9-11-24(12-10-23)16-20(27)25-7-5-4-6-8-25/h13-14,26,28H,4-12,15-16H2,1-3H3