methyl 4-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]benzoate CAS Name: 4-[[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]benzoate Traditional Name: 4-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]benzoic acid methyl ester Formula: C15H24N2O3+2 MolecularWeight: 280.36266

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CCO

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CCO

InChI

InChI=1S/C15H22N2O3/c1-20-15(19)14-4-2-13(3-5-14)12-17-8-6-16(7-9-17)10-11-18/h2-5,18H,6-12H2,1H3/p+2