2,6-ditert-butyl-4-[[4-[3-(4-chlorophenyl)-3-oxidanyl-propyl]piperazin-1-yl]methyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[[4-[3-(4-chlorophenyl)-3-oxidanyl-propyl]piperazin-1-yl]methyl]phenol Openeye Name: 2,6-ditert-butyl-4-[[4-[3-(4-chlorophenyl)-3-hydroxy-propyl]piperazin-1-yl]methyl]phenol CAS Name: 2,6-ditert-butyl-4-[[4-[3-(4-chlorophenyl)-3-hydroxypropyl]-1-piperazinyl]methyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[[4-[3-(4-chlorophenyl)-3-hydroxypropyl]piperazin-1-yl]methyl]phenol Traditional Name: 2,6-ditert-butyl-4-[[4-[3-(4-chlorophenyl)-3-hydroxy-propyl]piperazino]methyl]phenol Formula: C28H41ClN2O2 MolecularWeight: 473.09034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2CCN(CC2)CCC(C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2CCN(CC2)CCC(C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C28H41ClN2O2/c1-27(2,3)23-17-20(18-24(26(23)33)28(4,5)6)19-31-15-13-30(14-16-31)12-11-25(32)21-7-9-22(29)10-8-21/h7-10,17-18,25,32-33H,11-16,19H2,1-6H3