methyl 4-[3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoate dihydrochloride

Systemtic Name: methyl 4-[3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanyl-propoxy]benzoate dihydrochloride Openeye Name: methyl 4-[2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propoxy]benzoate dihydrochloride CAS Name: 4-[2-hydroxy-3-[4-(2-hydroxyethyl)-1-piperazinyl]propoxy]benzoic acid methyl ester dihydrochloride IUPAC Name: methyl 4-[2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propoxy]benzoate dihydrochloride Traditional Name: 4-[2-hydroxy-3-[4-(2-hydroxyethyl)piperazino]propoxy]benzoic acid methyl ester dihydrochloride Formula: C17H28Cl2N2O5 MolecularWeight: 411.32062

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)CCO)O.Cl.Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)CCO)O.Cl.Cl

InChI

InChI=1S/C17H26N2O5.2ClH/c1-23-17(22)14-2-4-16(5-3-14)24-13-15(21)12-19-8-6-18(7-9-19)10-11-20;;/h2-5,15,20-21H,6-13H2,1H3;2*1H