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4-[[6-[2-(4-hydroxyphenyl)ethyl]piperidin-2-yl]-oxidanyl-methyl]benzene-1,2-diol hydrobromide

4-[[6-[2-(4-hydroxyphenyl)ethyl]piperidin-2-yl]-oxidanyl-methyl]benzene-1,2-diol hydrobromide

Systemtic Name:4-[[6-[2-(4-hydroxyphenyl)ethyl]piperidin-2-yl]-oxidanyl-methyl]benzene-1,2-diol hydrobromide
Openeye Name:4-[hydroxy-[6-[2-(4-hydroxyphenyl)ethyl]-2-piperidyl]methyl]benzene-1,2-diol hydrobromide
CAS Name:4-[hydroxy-[6-[2-(4-hydroxyphenyl)ethyl]-2-piperidinyl]methyl]benzene-1,2-diol hydrobromide
IUPAC Name:4-[hydroxy-[6-[2-(4-hydroxyphenyl)ethyl]piperidin-2-yl]methyl]benzene-1,2-diol hydrobromide
Traditional Name:4-[hydroxy-[6-[2-(4-hydroxyphenyl)ethyl]-2-piperidyl]methyl]pyrocatechol hydrobromide
Formula: C20H26BrNO4
MolecularWeight: 424.32874
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC(C1)C(C2=CC(=C(C=C2)O)O)O)CCC3=CC=C(C=C3)O.Br


Isomeric SMILES

C1CC(NC(C1)C(C2=CC(=C(C=C2)O)O)O)CCC3=CC=C(C=C3)O.Br


InChI

InChI=1S/C20H25NO4.BrH/c22-16-9-5-13(6-10-16)4-8-15-2-1-3-17(21-15)20(25)14-7-11-18(23)19(24)12-14;/h5-7,9-12,15,17,20-25H,1-4,8H2;1H


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