4-[[4-[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]piperazin-1-yl]methyl]-2,6-dimethyl-phenol

Systemtic Name: 4-[[4-[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]piperazin-1-yl]methyl]-2,6-dimethyl-phenol Openeye Name: 4-[[4-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]piperazin-1-yl]methyl]-2,6-dimethyl-phenol CAS Name: 4-[[4-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-1-piperazinyl]methyl]-2,6-dimethylphenol IUPAC Name: 4-[[4-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]piperazin-1-yl]methyl]-2,6-dimethylphenol Traditional Name: 4-[[4-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]piperazino]methyl]-2,6-dimethyl-phenol Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CN2CCN(CC2)CC(C3=CC=C(C=C3)O)O

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CN2CCN(CC2)CC(C3=CC=C(C=C3)O)O

InChI

InChI=1S/C21H28N2O3/c1-15-11-17(12-16(2)21(15)26)13-22-7-9-23(10-8-22)14-20(25)18-3-5-19(24)6-4-18/h3-6,11-12,20,24-26H,7-10,13-14H2,1-2H3