(2S)-1-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-3-(4-methoxyphenoxy)propan-2-ol

Systemtic Name: (2S)-1-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-3-(4-methoxyphenoxy)propan-2-ol Openeye Name: (2S)-1-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-3-(4-methoxyphenoxy)propan-2-ol CAS Name: (2S)-1-[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]-3-(4-methoxyphenoxy)-2-propanol IUPAC Name: (2S)-1-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-3-(4-methoxyphenoxy)propan-2-ol Traditional Name: (2S)-1-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]-3-(4-methoxyphenoxy)propan-2-ol Formula: C16H28N2O4+2 MolecularWeight: 312.40452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(C[NH+]2CC[NH+](CC2)CCO)O

Isomeric SMILES

COC1=CC=C(C=C1)OC[C@H](C[NH+]2CC[NH+](CC2)CCO)O

InChI

InChI=1S/C16H26N2O4/c1-21-15-2-4-16(5-3-15)22-13-14(20)12-18-8-6-17(7-9-18)10-11-19/h2-5,14,19-20H,6-13H2,1H3/p+2/t14-/m0/s1