2-heptoxy-5-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzene-1,3-diol hydrochloride

Systemtic Name: 2-heptoxy-5-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzene-1,3-diol hydrochloride Openeye Name: 2-heptoxy-5-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzene-1,3-diol hydrochloride CAS Name: 2-heptoxy-5-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]benzene-1,3-diol hydrochloride IUPAC Name: 2-heptoxy-5-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]benzene-1,3-diol hydrochloride Traditional Name: 2-heptoxy-5-[[4-(2-hydroxyethyl)piperazino]methyl]resorcinol hydrochloride Formula: C20H35ClN2O4 MolecularWeight: 402.9559

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1O)CN2CCN(CC2)CCO)O.Cl

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1O)CN2CCN(CC2)CCO)O.Cl

InChI

InChI=1S/C20H34N2O4.ClH/c1-2-3-4-5-6-13-26-20-18(24)14-17(15-19(20)25)16-22-9-7-21(8-10-22)11-12-23;/h14-15,23-25H,2-13,16H2,1H3;1H